5-Chloro-1H-pyrrolo[3,2-b]pyridine supplier

Name
5-CHLORO-1H-PYRROLO[3,2-B] PYRIDINE
EINECS
CAS No. 65156-94-7
Article Data9
CAS DataBase
Density 1.425 g/cm³
Solubility
Melting Point
Formula C₇H₅ClN₂
Boiling Point 304.9 °C at 760 mmHg
Molecular Weight 152.583
Flash Point 166.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 5-Chloro-1H-pyrrolo[3,2-beta]pyridine;5-Chloro-4-azaindole;
PSA 28.68000
LogP 2.21630

5-Chloro-1H-pyrrolo[3,2-b]pyridine Specification

The IUPAC name of 1H-Pyrrolo[3,2-beta]pyridine,5-chloro- is 5-chloro-1H-pyrrolo[3,2-b]pyridine. With the CAS registry number 65156-94-7, it is also named as 5-Chloro-4-azaindole. In addition, its molecular formula is C₇H₅ClN₂ and its molecular weight is 152.58.

The other characteristics of 1H-Pyrrolo[3,2-beta]pyridine,5-chloro- can be summarized as: (1)ACD/LogP: 1.59; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.52; (4)ACD/LogD (pH 7.4): 1.59; (5)ACD/BCF (pH 5.5): 8.01; (6)ACD/BCF (pH 7.4): 9.55; (7)ACD/KOC (pH 5.5): 146.63; (8)ACD/KOC (pH 7.4): 174.89; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 28.68 Å²; (13)Index of Refraction: 1.703; (14)Molar Refractivity: 41.51 cm³; (15)Molar Volume: 107 cm³; (16)Polarizability: 16.45×10^-24cm³; (17)Surface Tension: 62.2 dyne/cm; (18)Density: 1.425 g/cm³; (19)Flash Point: 166.8 °C; (20)Enthalpy of Vaporization: 52.35 kJ/mol; (21)Boiling Point: 304.9 °C at 760 mmHg; (22)Vapour Pressure: 0.00153 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES: Clc1ccc2nccc2n1
(2)InChI: InChI=1/C7H5ClN2/c8-7-2-1-5-6(10-7)3-4-9-5/h1-4,9H
(3)InChIKey: RFPQVCYUKAYKEG-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C7H5ClN2/c8-7-2-1-5-6(10-7)3-4-9-5/h1-4,9H
(5)Std. InChIKey: RFPQVCYUKAYKEG-UHFFFAOYSA-N

Product Name

5-CHLORO-1H-PYRROLO[3,2-B] PYRIDINE

5-Chloro-1H-pyrrolo[3,2-b]pyridine Specification

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