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Imidazo[1,2-α]pyridine-6-carbonitrile

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Name

Imidazo[1,2-α]pyridine-6-carbonitrile

EINECS N/A
CAS No. 106850-34-4 Density 1.22 g/cm3
PSA 41.09000 LogP 1.20598
Solubility N/A Melting Point 160-163 °C
Formula C8H5N3 Boiling Point N/A
Molecular Weight 143.148 Flash Point N/A
Transport Information N/A Appearance N/A
Safety 26 Risk Codes  Harmful:;
Molecular Structure Molecular Structure of 106850-34-4 (IMIDAZO[1,2-A]PYRIDINE-6-CARBONITRILE) Hazard Symbols Xn
Synonyms

6-Cyanoimidazo[1,2-α]pyridine;4-Hydroimidazo[1,2-α]pyridine-6-carbonitrile;

Article Data 12

Imidazo[1,2-α]pyridine-6-carbonitrile Specification

The Imidazo[1,2-α]pyridine-6-carbonitrile, with the CAS registry number 106850-34-4, is also known as 4-Hydroimidazo[1,2-α]pyridine-6-carbonitrile. This chemical's molecular formula is C8H5N3 and molecular weight is 143.15. What's more, its systematic name is Imidazo[1,2-α]pyridine-6-carbonitrile.

Physical properties of Imidazo[1,2-α]pyridine-6-carbonitrile are: (1)ACD/LogP: 0.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.9; (4)ACD/LogD (pH 7.4): 0.93; (5)ACD/BCF (pH 5.5): 2.78; (6)ACD/BCF (pH 7.4): 2.98; (7)ACD/KOC (pH 5.5): 71.03; (8)ACD/KOC (pH 7.4): 75.99; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 41.09 Å2; (13)Index of Refraction: 1.664; (14)Molar Refractivity: 43.23 cm3; (15)Molar Volume: 116.4 cm3; (16)Polarizability: 17.14×10-24 cm3; (17)Surface Tension: 53.2 dyne/cm; (18)Density: 1.22 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: N#Cc1ccc2nccn2c1
(2)InChI: InChI=1/C8H5N3/c9-5-7-1-2-8-10-3-4-11(8)6-7/h1-4,6H
(3)InChIKey: LRJOKNYELSECDZ-UHFFFAOYAY

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