Ethanone,1-imidazo[1,2-a]pyridin-3-yl- supplier

Name
Ethanone, 1-imidazo[1,2-a]pyridin-3-yl- (9CI)
EINECS
CAS No. 29096-64-8
Article Data13
CAS DataBase
Density 1.21 g/cm³
Solubility
Melting Point 98-99 °C
Formula C₉H₈N₂O
Boiling Point
Molecular Weight 160.175
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-(Imidazo[1,2-a]pyridin-3-yl)ethanone;3-Acetylimidazo[1,2-a]pyridine;Imidazo[1,2-a]pyridine, ethanonederiv.;Ketone,imidazo[1,2-a]pyridin-3-yl methyl (8CI);
PSA 34.37000
LogP 1.53690

Ethanone,1-imidazo[1,2-a]pyridin-3-yl- Specification

The Ethanone,1-imidazo[1,2-a]pyridin-3-yl-, with the CAS registry number 29096-64-8, is also known as 3-Acetylimidazo[1,2-a]pyridine. It belongs to the product category of Acetylgroup. This chemical's molecular formula is C₉H₈N₂O and molecular weight is 198.22. What's more, its systematic name is 1-imidazo[1,2-a]pyridin-3-ylethanone.

Physical properties of Ethanone,1-imidazo[1,2-a]pyridin-3-yl- are: (1)ACD/LogP: 1.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.01; (4)ACD/LogD (pH 7.4): 1.03; (5)ACD/BCF (pH 5.5): 3.46; (6)ACD/BCF (pH 7.4): 3.55; (7)ACD/KOC (pH 5.5): 83.93; (8)ACD/KOC (pH 7.4): 86.12; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 34.37 Å²; (13)Index of Refraction: 1.622; (14)Molar Refractivity: 46.59 cm³; (15)Molar Volume: 132.2 cm³; (16)Polarizability: 18.47×10^-24cm³; (17)Surface Tension: 45.9 dyne/cm; (18)Density: 1.21 g/cm³.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(=O)c1cnc2ccccn12
(2)InChI: InChI=1S/C9H8N2O/c1-7(12)8-6-10-9-4-2-3-5-11(8)9/h2-6H,1H3
(3)InChIKey: GVIYJQYRNBCBJR-UHFFFAOYSA-N

Product Name

Ethanone, 1-imidazo[1,2-a]pyridin-3-yl- (9CI)

Ethanone,1-imidazo[1,2-a]pyridin-3-yl- Specification

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