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[ CAS No. 31127-39-6 ]

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Inaccessible (Haz class 6.1), Domestic USD 41.00
Inaccessible (Haz class 6.1), International USD 64.00
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2D
Chemical Structure| 31127-39-6
Chemical Structure| 31127-39-6
Structure of 31127-39-6 *Storage: {[proInfo.prStorage]}

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Alternatived Products of [ 31127-39-6 ]
Alternatived Products of [ 31127-39-6 ]

Product Details of [ 31127-39-6 ]

CAS No. :31127-39-6MDL No. :MFCD00862517
Formula : C9H9NO3 Boiling Point : 299.8°C at 760 mmHg
Linear Structure Formula :-InChI Key :N/A
M.W :179.17Pubchem ID :-
Synonyms :

Computed Properties of [ 31127-39-6 ]

TPSA : - H-Bond Acceptor Count : -
XLogP3 : - H-Bond Donor Count : -
SP3 : - Rotatable Bond Count : -

Safety of [ 31127-39-6 ]

Signal Word:DangerClass:4.1,6.1
Precautionary Statements:P240-P210-P241-P280-P370+P378-P501-P261-P270-P271-P264-P337+P313-P305+P351+P338-P361+P364-P332+P313-P301+P310+P330-P302+P352+P312-P304+P340+P311-P403+P233-P405UN#:2926
Hazard Statements:H228-H301+H311+H331-H315-H319Packing Group:
GHS Pictogram:

Application In Synthesis of [ 31127-39-6 ]

  • Upstream synthesis route of [ 31127-39-6 ]
  • Downstream synthetic route of [ 31127-39-6 ]

[ 31127-39-6 ] Synthesis Path-Upstream   1~2

  • 1
  • [ 29668-44-8 ]
  • [ 31127-39-6 ]
YieldReaction ConditionsOperation in experiment
98% With hydroxylamine hydrochloride; sodium hydroxide In ethanol at 80℃; for 4.00 h; Inert atmosphere General procedure: To a suspension of aldehyde (30/35 mmol) in ethanol (50 mL) was added NH2OH*HCl (2 eq) and NaOH pellets (1.8 eq). The suspension was stirred at 80 C for 4 h and concentrated in vacuo. The crude product was extracted in EtOAc (200 mL). The organic layer was washed with 1 N HCl (2 200 mL), water (4 200 mL), dried (MgSO4) and concentrated in vacuo. If TLC showed impurities, the solid was washed with a minimum of cold Et2O to afford the aldoxime as a white powder.
Reference: [1] European Journal of Medicinal Chemistry, 2016, vol. 108, p. 444 - 454
[2] Bioorganic and Medicinal Chemistry Letters, 2003, vol. 13, # 10, p. 1795 - 1799
[3] Bioorganic and Medicinal Chemistry, 2004, vol. 12, # 15, p. 3965 - 3970
[4] Bulletin of the Korean Chemical Society, 2012, vol. 33, # 12, p. 4227 - 4230
[5] Advanced Synthesis and Catalysis, 2014, vol. 356, # 5, p. 977 - 981
[6] Bioorganic and Medicinal Chemistry, 2016, vol. 24, # 21, p. 5440 - 5448
[7] Bioorganic and Medicinal Chemistry Letters, 2017, vol. 27, # 12, p. 2674 - 2677
[8] Bioorganic and Medicinal Chemistry Letters, 2018, vol. 28, # 23-24, p. 3741 - 3747
  • 2
  • [ 124362-47-6 ]
  • [ 31127-39-6 ]
Reference: [1] Patent: CN108117534, 2018, A. Location in patent: Paragraph 1177; 1178; 1179
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