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Basic Information
CAS No.: 851723-84-7
Name: OC000459
Molecular Structure:
Molecular Structure of 851723-84-7 (OC000459)
Formula: C21H17FN2O2
Molecular Weight: 348.37
Synonyms: [5-Fluoro-2-methyl-3-(quinolin-2-ylmethyl)indol-1-yl]acetic acid;
Density: 1.297 g/cm3
Boiling Point: 574.416 °C at 760 mmHg
Flash Point: 301.196 °C
PSA: 55.12000
LogP: 4.31240
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    Wuhan Bright Chemical Co., Ltd is set up in 2008. We mainly concentrate on producing, researching and trading electroplating intermediates, Fluoro -containing chemicals,Silicone o

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  • Factory supply anti-hairloss OC000459 CAS 851723-84-7

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    851723-84-7

    Factory supply anti-hairloss OC000459 CAS 851723-84-7

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    Factory supply anti-hairloss OC000459 CAS 851723-84-7Appearance:white powder Storage:keep in dry and cool Package:according to your request Application:Food additives Transportation:By express (Door to door) such as FEDEX, DHL, EMS for small amount.

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  • OC000459

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    851723-84-7

    OC000459

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    Best Seller, High Quality, Competitive Price, Fast Delivery, Quick ResponseAppearance:powder, or liquid Storage:Stored in room temperature, ventilated place Package:Bottle, barrel, cargo, container, etc. Application:Pharmaceuticals, intermediates, AP

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Specification

The 1H-Indole-1-acetic acid, 5-fluoro-2-methyl-3-(2-quinolinylmethyl)-, with the CAS registry number 851723-84-7, is also known as [5-Fluoro-2-methyl-3-(quinolin-2-ylmethyl)indol-1-yl]acetic acid. This chemical's molecular formula is C21H17FN2O2 and molecular weight is 348.37. What's more, its systematic name is called [5-Fluoro-2-methyl-3-(2-quinolinylmethyl)-1H-indol-1-yl]acetic acid.

Physical properties about 1H-Indole-1-acetic acid, 5-fluoro-2-methyl-3-(2-quinolinylmethyl)- are: (1)ACD/LogP: 3.603; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.11; (4)ACD/LogD (pH 7.4): 0.49; (5)ACD/BCF (pH 5.5): 10.40; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 70.10; (8)ACD/KOC (pH 7.4): 1.68; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 55.12 Å2; (13)Index of Refraction: 1.646; (14)Molar Refractivity: 97.531 cm3; (15)Molar Volume: 268.593 cm3; (16)Polarizability: 38.664×10-24cm3; (17)Surface Tension: 47.159 dyne/cm; (18)Density: 1.297 g/cm3; (19)Flash Point: 301.196 °C; (20)Enthalpy of Vaporization: 90.532 kJ/mol; (21)Boiling Point: 574.416 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1cc2c(cc1)n(c(c2Cc3nc4c(cc3)cccc4)C)CC(=O)O
(2) InChI: InChI=1S/C21H17FN2O2/c1-13-17(11-16-8-6-14-4-2-3-5-19(14)23-16)18-10-15(22)7-9-20(18)24(13)12-21(25)26/h2-10H,11-12H2,1H3,(H,25,26)
(3) InChIKey: FATGTHLOZSXOBC-UHFFFAOYSA-N