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1H-Pyrrolo[3,2-c]pyridine,4-chloro-1-methyl-

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Name

1H-Pyrrolo[3,2-c]pyridine,4-chloro-1-methyl-

EINECS
CAS No. 27382-01-0 Density 1.3 g/cm3
Solubility Melting Point
Formula C8H7ClN2 Boiling Point 312.026 °C at 760 mmHg
Molecular Weight 166.6076 Flash Point 142.509 °C
Transport Information Appearance
Safety Risk Codes
Molecular Structure Molecular Structure of 27382-01-0 (1H-Pyrrolo[3,2-c]pyridine,4-chloro-1-methyl-) Hazard Symbols
Synonyms

4-Chloro-1-methyl-5-azaindole;

 

1H-Pyrrolo[3,2-c]pyridine,4-chloro-1-methyl- Specification

The 1H-Pyrrolo[3,2-c]pyridine,4-chloro-1-methyl-, with the CAS registry number 27382-01-0, is also known as 4-Chloro-1-methyl-5-azaindole. It belongs to the product categories of Heterocycles series; Fused Ring Systems; Halides. This chemical's molecular formula is C8H7ClN2 and molecular weight is 166.6076. What's more, its systematic name is called 4-Chloro-1-methyl-1H-pyrrolo[3,2-c]pyridine.

Physical properties about 1H-Pyrrolo[3,2-c]pyridine,4-chloro-1-methyl- are: (1)ACD/LogP: 1.88; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 2; (6)ACD/BCF (pH 7.4): 11; (7)ACD/KOC (pH 5.5): 30; (8)ACD/KOC (pH 7.4): 191; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 17.82 Å2; (13)Index of Refraction: 1.633; (14)Molar Refractivity: 45.738 cm3; (15)Molar Volume: 128.124 cm3; (16)Polarizability: 18.132×10-24 cm3; (17)Surface Tension: 43.395 dyne/cm; (18)Density: 1.3 g/cm3; (19)Flash Point: 142.509 °C; (20)Enthalpy of Vaporization: 53.094 kJ/mol; (21)Boiling Point: 312.026 °C at 760 mmHg; (22)Vapour Pressure: 0.001 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc2nccc1c2ccn1C
(2) InChI: InChI=1/C8H7ClN2/c1-11-5-3-6-7(11)2-4-10-8(6)9/h2-5H,1H3
(3) InChIKey: YDHGAILLVNWKRE-UHFFFAOYAU

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