Home Cart 0 Sign in  

[ CAS No. 14353-88-9 ] {[proInfo.proName]}

,{[proInfo.pro_purity]}
Cat. No.: {[proInfo.prAm]}
HazMat Fee +

There will be a HazMat fee per item when shipping a dangerous goods. The HazMat fee will be charged to your UPS/DHL/FedEx collect account or added to the invoice unless the package is shipped via Ground service. Ship by air in Excepted Quantity (each bottle), which is up to 1g/1mL for class 6.1 packing group I or II, and up to 25g/25ml for all other HazMat items.

Type HazMat fee for 500 gram (Estimated)
Excepted Quantity USD 0.00
Limited Quantity USD 15-60
Inaccessible (Haz class 6.1), Domestic USD 80+
Inaccessible (Haz class 6.1), International USD 150+
Accessible (Haz class 3, 4, 5 or 8), Domestic USD 100+
Accessible (Haz class 3, 4, 5 or 8), International USD 200+
Chemical Structure| 14353-88-9
Chemical Structure| 14353-88-9
Structure of 14353-88-9 * Storage: {[proInfo.prStorage]}
Cart0 Add to My Favorites Add to My Favorites Bulk Inquiry Inquiry Add To Cart

Quality Control of [ 14353-88-9 ]

Related Doc. of [ 14353-88-9 ]

Alternatived Products of [ 14353-88-9 ]

Product Details of [ 14353-88-9 ]

CAS No. :14353-88-9 MDL No. :MFCD00191612
Formula : C10F11IO4 Boiling Point : -
Linear Structure Formula :- InChI Key :OQWAXRPJEPTTSZ-UHFFFAOYSA-N
M.W : 519.99 Pubchem ID :626316
Synonyms :

Calculated chemistry of [ 14353-88-9 ]

Physicochemical Properties

Num. heavy atoms : 26
Num. arom. heavy atoms : 6
Fraction Csp3 : 0.2
Num. rotatable bonds : 7
Num. H-bond acceptors : 15.0
Num. H-bond donors : 0.0
Molar Refractivity : 63.24
TPSA : 52.6 Ų

Pharmacokinetics

GI absorption : Low
BBB permeant : No
P-gp substrate : No
CYP1A2 inhibitor : No
CYP2C19 inhibitor : No
CYP2C9 inhibitor : Yes
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -5.56 cm/s

Lipophilicity

Log Po/w (iLOGP) : 0.0
Log Po/w (XLOGP3) : 5.51
Log Po/w (WLOGP) : 8.72
Log Po/w (MLOGP) : 4.86
Log Po/w (SILICOS-IT) : 5.88
Consensus Log Po/w : 5.0

Druglikeness

Lipinski : 2.0
Ghose : None
Veber : 0.0
Egan : 1.0
Muegge : 2.0
Bioavailability Score : 0.17

Water Solubility

Log S (ESOL) : -6.24
Solubility : 0.000296 mg/ml ; 0.00000057 mol/l
Class : Poorly soluble
Log S (Ali) : -6.37
Solubility : 0.00022 mg/ml ; 0.000000423 mol/l
Class : Poorly soluble
Log S (SILICOS-IT) : -5.7
Solubility : 0.00104 mg/ml ; 0.00000199 mol/l
Class : Moderately soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 3.0 alert
Leadlikeness : 2.0
Synthetic accessibility : 3.49

Safety of [ 14353-88-9 ]

Signal Word:Danger Class:8
Precautionary Statements:P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P405-P501 UN#:1759
Hazard Statements:H314 Packing Group:
GHS Pictogram:

Application In Synthesis of [ 14353-88-9 ]

* 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.

  • Upstream synthesis route of [ 14353-88-9 ]
  • Downstream synthetic route of [ 14353-88-9 ]

[ 14353-88-9 ] Synthesis Path-Upstream   1~6

  • 1
  • [ 591-50-4 ]
  • [ 14353-88-9 ]
  • [ 827-15-6 ]
  • [ 2712-78-9 ]
Reference: [1] Angewandte Chemie - International Edition, 2010, vol. 49, # 15, p. 2786 - 2789
  • 2
  • [ 106-46-7 ]
  • [ 14353-88-9 ]
  • [ 320-50-3 ]
Reference: [1] ACS Catalysis, 2018, vol. 8, # 4, p. 2839 - 2843
  • 3
  • [ 14353-88-9 ]
  • [ 98-86-2 ]
  • [ 709-63-7 ]
  • [ 17408-14-9 ]
  • [ 349-76-8 ]
Reference: [1] ACS Catalysis, 2018, vol. 8, # 4, p. 2839 - 2843
  • 4
  • [ 14353-88-9 ]
  • [ 3058-39-7 ]
  • [ 101066-87-9 ]
Reference: [1] ACS Catalysis, 2018, vol. 8, # 4, p. 2839 - 2843
  • 5
  • [ 14353-88-9 ]
  • [ 619-42-1 ]
  • [ 107317-58-8 ]
  • [ 957207-58-8 ]
Reference: [1] ACS Catalysis, 2018, vol. 8, # 4, p. 2839 - 2843
  • 6
  • [ 14353-88-9 ]
  • [ 619-42-1 ]
  • [ 107317-58-8 ]
  • [ 957207-58-8 ]
Reference: [1] ACS Catalysis, 2018, vol. 8, # 4, p. 2839 - 2843
Same Skeleton Products
Historical Records