120085-99-6|4,4-(1,10-Phenanthroline-2,9-diyl)bis[benzaldehyde]| Ambeed

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Quality Control of [ 120085-99-6 ] Purity: 98% SDS Specification

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Product Details of [ 120085-99-6 ]

CAS No. :	120085-99-6
Formula :	C₂₆H₁₆N₂O₂
M.W :	388.42
SMILES Code :	O=CC1=CC=C(C2=CC=C3C=CC4=CC=C(C5=CC=C(C=C5)C=O)N=C4C3=N2)C=C1
MDL No. :	MFCD31539985
InChI Key :	UGTIDCSATIABNJ-UHFFFAOYSA-N
Pubchem ID :	21762041

Safety of [ 120085-99-6 ]

GHS Pictogram:
Signal Word:	Warning
Hazard Statements:	H302-H315-H319-H335
Precautionary Statements:	P261-P280-P301+P312-P302+P352-P305+P351+P338

Application In Synthesis of [ 120085-99-6 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

Downstream synthetic route of [ 120085-99-6 ]

[ 120085-99-6 ] Synthesis Path-Downstream 1~35

1
[ 109-97-7 ]
[ 17610-00-3 ]
[ 120085-99-6 ]
[ 89372-90-7 ]
[ 120086-00-2 ]

References: [1]Angewandte Chemie,1989,vol. 101,p. 631 - 632.
[2]Tetrahedron,1991,vol. 47,p. 5123 - 5132.

2
[ 120085-99-6 ]
[ 157523-12-1 ]

References: [1]Journal of the American Chemical Society,1995,vol. 117,p. 8447 - 8455.
[2]Journal of the Chemical Society, Dalton Transactions,1994,p. 1649 - 1654.

3
[ 120085-98-5 ]
[ 120085-99-6 ]

Yield	Reaction Conditions	Operation in experiment
0.92 g (80%)	With sodium hydroxide; In tetrahydrofuran; water; propionic acid;	2,9-bis(4-formylphenyl)-1,10-phenanthroline (4). Compound (3) (2.00 g, 2.96 mmol) and powdered NaOH (0.71 g, 17.7 mmol) were refluxed in propionic acid (15 mL) for 6 h under argon. The propionic acid was evaporated under reduced pressure and replaced with THF (25 mL) and 2M NaOH (5 mL). The solution was stirred for 1 h, and then the THF was evaporated. Water (20 mL) was added and the pH adjusted to ~8 with HCl. The solution was extracted with CH2 Cl2 (3*100 mL). Yield 0.92 g (80%). 1 H NMR (CDCl3) δ8.38 (s, 2H), 8.64 (d, J=8.4 Hz, 4H), 8.42 (d, J=8.4 Hz, 2H), 8.25 (d, J=8.4 Hz, 2H), 8.13 (d, J=8.4 Hz, 4H), 7.89 (s, 2H).

References: [1]Angewandte Chemie,1989,vol. 101,p. 631 - 632.
[2]Patent: US5998594,1999,A .

4
[ 116287-98-0 ]
[ 802294-64-0 ]
[ 116288-00-7 ]
[ 120085-99-6 ]

References: [1]Tetrahedron,1991,vol. 47,p. 5123 - 5132.

5
[ 157523-11-0 ]
[ 120085-99-6 ]

References: [1]Journal of the Chemical Society, Dalton Transactions,1994,p. 1649 - 1654.

6
[ 92415-30-0 ]
[ 120085-99-6 ]
C₁₁₂H₁₀₀N₁₂ [ No CAS ]

References: [1]Bulletin de la Societe Chimique de France,1995,vol. 132,p. 340 - 347.

7
[ 92415-30-0 ]
[ 17610-00-3 ]
[ 120085-99-6 ]
C₁₁₆H₁₂₈N₁₀ [ No CAS ]

References: [1]Tetrahedron Letters,1995,vol. 36,p. 9321 - 9324.

8
[ 92415-30-0 ]
[ 17610-00-3 ]
[ 120085-99-6 ]
C₁₁₆H₁₂₈N₁₀ [ No CAS ]

References: [1]Chemistry - A European Journal,1999,vol. 5,p. 2089 - 2100.

9
[ 321697-17-0 ]
[ 120085-99-6 ]

Yield	Reaction Conditions	Operation in experiment
84%	With hydrogenchloride; water; In tetrahydrofuran; at 20℃; for 48h;	Synthesis of 4,4'-(1,10-phenanthroline-2,9-diyl)dibenzaldehyde (4; Scheme I) A 5% HCl aqueous solution (36 mL) was added to a stirring solution of 3 (900 mg, 1.61 mmol) in tetrahydrofuran (180 mL). The mixture was stirred at ambient temperature for 48 h, and then the solvent was evaporated in vacuo. The residue was suspended in a saturated NaHCO3 aqueous solution (100 mL) and DCM (100 mL). The organic layer was collected and dried over MgSO4. The solvent was removed by evaporation and resulting crude product was purified by column chromatography using DCM.

References: [1]Journal of the American Chemical Society,2000,vol. 122,p. 11834 - 11844.
[2]Patent: US2018/319821,2018,A1 .Location in patent: Paragraph 0108.

10
[ 66-71-7 ]
[ 120085-99-6 ]

References: [1]Journal of the American Chemical Society,2000,vol. 122,p. 11834 - 11844.
[2]Journal of the Chemical Society, Dalton Transactions,1994,p. 1649 - 1654.
[3]Tetrahedron,1991,vol. 47,p. 5123 - 5132.

11
[ 105114-53-2 ]
[ 120085-99-6 ]

References: [1]Journal of the American Chemical Society,2000,vol. 122,p. 11834 - 11844.

12
[ 120085-99-6 ]
C₂₆H₁₄Cl₂N₂O₂ [ No CAS ]

References: [1]Journal of the American Chemical Society,1995,vol. 117,p. 8447 - 8455.

13
[ 120085-99-6 ]
[ 167496-52-8 ]

References: [1]Journal of the American Chemical Society,1995,vol. 117,p. 8447 - 8455.

14
[ 17100-68-4 ]
[ 120085-99-6 ]

References: [1]Journal of the Chemical Society, Dalton Transactions,1994,p. 1649 - 1654.

15
[ 157523-08-5 ]
[ 120085-99-6 ]

References: [1]Journal of the Chemical Society, Dalton Transactions,1994,p. 1649 - 1654.

16
[ 157523-10-9 ]
[ 120085-99-6 ]

References: [1]Journal of the Chemical Society, Dalton Transactions,1994,p. 1649 - 1654.

17
[ 116287-98-0 ]
[ 120085-99-6 ]

References: [1]Angewandte Chemie,1989,vol. 101,p. 631 - 632.

18
[ 2417-95-0 ]
[ 120085-99-6 ]

References: [1]Tetrahedron,1991,vol. 47,p. 5123 - 5132.

19
[ 64443-05-6 ]
[ 305344-46-1 ]
[ 120085-99-6 ]
[(C₁₂H₆N₂(C₆H₄CHO)2)Cu(C₁₂H₆N₂(C₆H₄OC₂H₄OC₆H₄)2(C₅H₂N)4(C₆H₃(C(CH₃)3)2)2)Au]⁽²⁺⁾*2PF₆^(1-)=C₁₁₄H₉₆AuCuF₁₂N₈O₆P₂ [ No CAS ]

References: [1]Journal of the American Chemical Society,2000,vol. 122,p. 11834 - 11844.

20
tetrakis(acetonitrile)copper(I)tetrafluoroborate [ No CAS ]
[ 90030-13-0 ]
[ 120085-99-6 ]
[ 165814-91-5 ]

References: [1]Journal of the American Chemical Society,2002,vol. 124,p. 4347 - 4362.

21
[ 17084-13-8 ]
tetrakis(acetonitrile)copper(I)tetrafluoroborate [ No CAS ]
[ 175090-11-6 ]
[ 120085-99-6 ]
[[((CHC₅H₂N(C₆H₄OC₂H₄OC₂H₄O))2C₆H₃(C(C₄H₂N(C(C₆H₃(C₄H₉)2))3C₄H₂N)Au)]Cu[2,9-bis-(p-formylphenyl)-1,10-phenanthroline]](PF₆)2 [ No CAS ]

References: [1]Journal of the American Chemical Society,2002,vol. 124,p. 4347 - 4362.

22
[ 64443-05-6 ]
[ 175090-11-6 ]
[ 120085-99-6 ]
[ 198268-48-3 ]

References: [1]Journal of the American Chemical Society,1997,vol. 119,p. 11329 - 11330.

23
[ 116287-98-0 ]
[ 802294-64-0 ]
[ 1065070-91-8 ]
[ 116288-00-7 ]
[ 120085-99-6 ]

References: [1]Tetrahedron,2008,vol. 64,p. 8496 - 8503.

24
[ 109-97-7 ]
[ 17610-00-3 ]
[ 120085-99-6 ]
[ 120086-00-2 ]

References: [1]European Journal of Organic Chemistry,2009,p. 2801 - 2805.

25
[ 87199-17-5 ]
[ 29176-55-4 ]
[ 120085-99-6 ]

References: [1]ChemMedChem,2017,vol. 12,p. 146 - 160.
[2]Chemical Biology and Drug Design,2018,vol. 91,p. 974 - 995.
[3]Archiv der Pharmazie,2021,vol. 354.

26
[ 120085-99-6 ]
2,9-bis{4-[(3-dimethylaminopropyl)aminomethyl]phenyl}-1,10-phenanthroline [ No CAS ]

References: [1]ChemMedChem,2017,vol. 12,p. 146 - 160.
[2]Chemical Biology and Drug Design,2018,vol. 91,p. 974 - 995.

27
[ 120085-99-6 ]
2,9-bis{4-[(3-(4-methylpiperazin-1-yl)propyl)aminomethyl]phenyl}-1,10-phenanthroline [ No CAS ]

References: [1]ChemMedChem,2017,vol. 12,p. 146 - 160.
[2]Chemical Biology and Drug Design,2018,vol. 91,p. 974 - 995.

28
[ 120085-99-6 ]
2,9-bis{4-[(3-pyrrolidinopropyl)aminomethyl]phenyl}-1,10-phenanthroline [ No CAS ]

References: [1]ChemMedChem,2017,vol. 12,p. 146 - 160.
[2]Chemical Biology and Drug Design,2018,vol. 91,p. 974 - 995.

29
[ 120085-99-6 ]
2,9-bis{4-[(3-dimethylaminopropyl)aminomethyl]phenyl}-1,10-phenanthroline tetraoxalate [ No CAS ]

References: [1]ChemMedChem,2017,vol. 12,p. 146 - 160.

30
[ 120085-99-6 ]
2,9-bis{4-[(3-(4-methylpiperazin-1-yl)propyl)aminomethyl]phenyl}-1,10-phenanthroline hexaoxalate [ No CAS ]

References: [1]ChemMedChem,2017,vol. 12,p. 146 - 160.

31
[ 120085-99-6 ]
2,9-bis{4-[(3-pyrrolidinopropyl)aminomethyl]phenyl}-1,10-phenanthroline tetraoxalate [ No CAS ]

References: [1]ChemMedChem,2017,vol. 12,p. 146 - 160.

32
[ 120085-99-6 ]
2,9-bis{4-[(3-morpholinopropyl)aminomethyl]phenyl}-1,10-phenanthroline tetraoxalate [ No CAS ]

References: [1]ChemMedChem,2017,vol. 12,p. 146 - 160.

33
[ 120085-99-6 ]
[ 109-55-7 ]
2,9-bis{4-[(3-dimethylaminopropyl)iminomethyl]phenyl}-1,10-phenanthroline [ No CAS ]

References: [1]ChemMedChem,2017,vol. 12,p. 146 - 160.
[2]Chemical Biology and Drug Design,2018,vol. 91,p. 974 - 995.

34
[ 4572-03-6 ]
[ 120085-99-6 ]
2,9-bis{4-[(3-(4-methylpiperazin-1-yl)propyl)iminomethyl]phenyl}-1,10-phenanthroline [ No CAS ]

References: [1]ChemMedChem,2017,vol. 12,p. 146 - 160.
[2]Chemical Biology and Drug Design,2018,vol. 91,p. 974 - 995.

35
[ 23159-07-1 ]
[ 120085-99-6 ]
2,9-bis{4-[(3-pyrrolidinopropyl)iminomethyl]phenyl}-1,10-phenanthroline [ No CAS ]

References: [1]ChemMedChem,2017,vol. 12,p. 146 - 160.
[2]Chemical Biology and Drug Design,2018,vol. 91,p. 974 - 995.

Historical Records

Technical Information

• Benzylic Oxidation • Birch Reduction • Blanc Chloromethylation • Friedel-Crafts Reaction • Hydrogenolysis of Benzyl Ether • Preparation of Alkylbenzene • Reactions of Benzene and Substituted Benzenes • Vilsmeier-Haack Reaction

Precautionary Statements-General
Code	Phrase
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P221	Take any precaution to avoid mixing with combustibles
P222	Do not allow contact with air.
P223	Keep away from any possible contact with water, because of violent reaction and possible flash fire.
P230	Keep wetted
P231	Handle under inert gas.
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P233	Keep container tightly closed.
P234	Keep only in original container.
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P231 + P232	Handle under inert gas. Protect from moisture.
P235 + P410	Keep cool. Protect from sunlight.
Response
Code	Phrase
P301	IF SWALLOWED:
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P310	Immediately call a POISON CENTER or doctor/physician.
P311	Call a POISON CENTER or doctor/physician.
P312	Call a POISON CENTER or doctor/physician if you feel unwell.
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P314	Get medical advice/attention if you feel unwell.
P315	Get immediate medical advice/attention.
P320
P302 + P352	IF ON SKIN: wash with plenty of soap and water.
P321
P322
P330	Rinse mouth.
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P332	IF SKIN irritation occurs:
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P334	Immerse in cool water/wrap n wet bandages.
P335	Brush off loose particles from skin.
P336	Thaw frosted parts with lukewarm water. Do not rub affected area.
P337	If eye irritation persists:
P338	Remove contact lenses, if present and easy to do. Continue rinsing.
P340	Remove victim to fresh air and keep at rest in a position comfortable for breathing.
P341	If breathing is difficult, remove victim to fresh air and keep at rest in a position comfortable for breathing.
P342	If experiencing respiratory symptoms:
P350	Gently wash with plenty of soap and water.
P351	Rinse cautiously with water for several minutes.
P352	Wash with plenty of soap and water.
P353	Rinse skin with water/shower.
P360	Rinse immediately contaminated clothing and skin with plenty of water before removing clothes.
P361	Remove/Take off immediately all contaminated clothing.
P362	Take off contaminated clothing and wash before reuse.
P363	Wash contaminated clothing before reuse.
P370	In case of fire:
P371	In case of major fire and large quantities:
P372	Explosion risk in case of fire.
P373	DO NOT fight fire when fire reaches explosives.
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P376	Stop leak if safe to do so. Oxidising gases (section 2.4) 1
P377	Leaking gas fire: Do not extinguish, unless leak can be stopped safely.
P378
P380	Evacuate area.
P381	Eliminate all ignition sources if safe to do so.
P390	Absorb spillage to prevent material damage.
P391	Collect spillage. Hazardous to the aquatic environment
P301 + P310	IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
P301 + P312	IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P301 + P330 + P331	IF SWALLOWED: Rinse mouth. Do NOT induce vomiting.
P302 + P334	IF ON SKIN: Immerse in cool water/wrap in wet bandages.
P302 + P350	IF ON SKIN: Gently wash with plenty of soap and water.
P303 + P361 + P353	IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P304 + P312	IF INHALED: Call a POISON CENTER or doctor/physician if you feel unwell.
P304 + P340	IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P304 + P341	IF INHALED: If breathing is difficult, remove victim to fresh air and keep at rest in a position comfortable for breathing.
P305 + P351 + P338	IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
P306 + P360	IF ON CLOTHING: Rinse Immediately contaminated CLOTHING and SKIN with plenty of water before removing clothes.
P307 + P311	IF exposed: call a POISON CENTER or doctor/physician.
P308 + P313	IF exposed or concerned: Get medical advice/attention.
P309 + P311	IF exposed or if you feel unwell: call a POISON CENTER or doctor/physician.
P332 + P313	IF SKIN irritation occurs: Get medical advice/attention.
P333 + P313	IF SKIN irritation or rash occurs: Get medical advice/attention.
P335 + P334	Brush off loose particles from skin. Immerse in cool water/wrap in wet bandages.
P337 + P313	IF eye irritation persists: Get medical advice/attention.
P342 + P311	IF experiencing respiratory symptoms: call a POISON CENTER or doctor/physician.
P370 + P376	In case of fire: Stop leak if safe to Do so.
P370 + P378	In case of fire:
P370 + P380	In case of fire: Evacuate area.
P370 + P380 + P375	In case of fire: Evacuate area. Fight fire remotely due to the risk of explosion.
P371 + P380 + P375	In case of major fire and large quantities: Evacuate area. Fight fire remotely due to the risk of explosion.
Storage
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P401
P402	Store in a dry place.
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P411
P412	Do not expose to temperatures exceeding 50 oC/ 122 oF.
P413
P420	Store away from other materials.
P422
P402 + P404	Store in a dry place. Store in a closed container.
P403 + P233	Store in a well-ventilated place. Keep container tightly closed.
P403 + P235	Store in a well-ventilated place. Keep cool.
P410 + P403	Protect from sunlight. Store in a well-ventilated place.
P410 + P412	Protect from sunlight. Do not expose to temperatures exceeding 50 oC/122oF.
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Disposal
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Physical hazards
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H250	Catches fire spontaneously if exposed to air
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H260	In contact with water releases flammable gases which may ignite spontaneously
H261	In contact with water releases flammable gas
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Health hazards
Code	Phrase
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H310	Fatal in contact with skin
H311	Toxic in contact with skin
H312	Harmful in contact with skin
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H314	Causes severe skin burns and eye damage
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Environmental hazards
Code	Phrase
H400	Very toxic to aquatic life
H401	Toxic to aquatic life
H402	Harmful to aquatic life
H410	Very toxic to aquatic life with long-lasting effects
H411	Toxic to aquatic life with long-lasting effects
H412	Harmful to aquatic life with long-lasting effects
H413	May cause long-lasting harmful effects to aquatic life
H420	Harms public health and the environment by destroying ozone in the upper atmosphere

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CAS No.: 120085-99-6

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CAS No.: 120085-99-6

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Product Details of [ 120085-99-6 ]

Safety of [ 120085-99-6 ]

Application In Synthesis of [ 120085-99-6 ]

[ 120085-99-6 ] Synthesis Path-Downstream 1~35

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Historical Records

Technical Information

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Precautionary Statements-General

Prevention

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