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1015610-07-7

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Basic Information
CAS No.: 1015610-07-7
Name: (4-Chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanol
Molecular Structure:
Molecular Structure of 1015610-07-7 ((4-Chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanol)
Formula: C8H7ClN2O
Molecular Weight: 182.607
Synonyms: (4-Chloro-1H-pyrrolo[3,2-e]pyridin-5-yl)methanol;
Density: 1.51 g/cm3
Hazard Symbols: IrritantXi
Risk Codes: 22
PSA: 48.91000
LogP: 1.70860
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    Ansciep Chemical is a professional enterprise manufacturing and distributing fine chemicals and speciality chemicals. We have been dedicated to heterocycle compounds and phenyl rings for tens of years. This is our mature product for export. Our quali

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    We are committed to providing our customers with the best products and services at the most competitive prices.Appearance:white to light yellow crystal powder Storage:Room temperature with sealed well Package:according to the clients requirement Appl

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Specification

The IUPAC name of this product is (4-Chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanol, and its CAS registry number is 1015610-07-7. This chemical's molecular formula is C8H7ClN2O and molecular weight is 182.607. In addition, this chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about (4-Chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanol are: (1)ACD/LogP: 1.33; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.32; (4)ACD/LogD (pH 7.4): 1.33; (5)#H bond acceptors: 3; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 48.91 Å2; (9)Index of Refraction: 1.724; (10)Molar Refractivity: 47.96 cm3; (11)Molar Volume: 120.8 cm3; (12)Polarizability: 19.01×10-24 cm3; (13)Surface Tension: 73.8 dyne/cm; (14)Density: 1.51 g/cm3.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1c(cnc2nccc12)CO
(2) InChI: InChI=1/C8H7ClN2O/c9-7-5(4-12)3-11-8-6(7)1-2-10-8/h1-3,12H,4H2,(H,10,11)
(3) InChIKey: XRAYGQBBYROBPT-UHFFFAOYAJ