CAS No.117890-55-8,2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	117890-55-8
Name:	2-chloro-6,7-dihydro-5H-cyclopenta[b]pyridine
Article Data:	9

Formula:	C₈H₈ClN
Molecular Weight:	153.611
Synonyms:	5H-cyclopenta[b]pyridine, 2-chloro-6, 7-dihydro-;
Density:	1.242 g/cm³
Boiling Point:	236.528 °C at 760 mmHg
Flash Point:	119.643 °C
PSA:	12.89000
LogP:	2.22370

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Specification

The 2-Chloro-6, 7-dihydro-5H-cyclopenta[b]pyridine, with the CAS registry number of 117890-55-8, is also known as 5H-cyclopenta[b]pyridine, 2-chloro-6, 7-dihydro-. This chemical's molecular formula is C₈H₈ClN and molecular weight is 153.611. What's more, its systematic name is called 2-Chloro-6, 7-dihydro-5H-cyclopenta[b]pyridine.

Physical properties about 2-Chloro-6, 7-dihydro-5H-cyclopenta[b]pyridine are: (1)ACD/LogP: 2.32; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3; (4)ACD/LogD (pH 7.4): 3; (5)ACD/BCF (pH 5.5): 48; (6)ACD/BCF (pH 7.4): 48; (7)ACD/KOC (pH 5.5): 559; (8)ACD/KOC (pH 7.4): 559; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 12.89 Å²; (13)Index of Refraction: 1.584; (14)Molar Refractivity: 41.413 cm³; (15)Molar Volume: 123.699 cm³; (16)Surface Tension: 46.782 dyne/cm; (17)Density: 1.242 g/cm³; (18)Flash Point: 119.643 °C; (19)Enthalpy of Vaporization: 45.412 kJ/mol; (20)Boiling Point: 236.528 °C at 760 mmHg; (21)Vapour Pressure: 0.072 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1ccc2CCCc2n1
(2) InChI: InChI=1/C8H8ClN/c9-8-5-4-6-2-1-3-7(6)10-8/h4-5H,1-3H2
(3) InChIKey: PBMLTRUXYZHCFT-UHFFFAOYAD