CAS No.70705-33-8,7-METHYL-IMIDAZO[1,2-A]PYRIDINE-2-CARBOXYLIC ACID ETHYL ESTER Suppliers

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Basic Information

Molecular Structure:
CAS No.:	70705-33-8
Name:	7-METHYL-IMIDAZO[1,2-A]PYRIDINE-2-CARBOXYLIC ACID ETHYL ESTER
Article Data:	7

Formula:	C₁₁H₁₂N₂O₂
Molecular Weight:	204.228
Synonyms:	Ethyl 7-methylimidazo[1,2-a]pyridine-2-carboxylate;7-Methyl-imidazo[1,2-a]pyridine-2-carboxylic acid ethyl ester;Ethyl 7-methylimidazo[1,2-a]pyridine-2-carboxylate;Imidazo[1,2-a]pyridine-2-carboxylic acid, 7-methyl-, ethyl ester;7-Methyl-imidazo[1,2-a]pyridine-2-carboxylic acid;
Density:	1.2 g/cm³
Melting Point:	126-129oC
Hazard Symbols:	Xi
Risk Codes:	Xi:; "> Xi:;
PSA:	43.60000
LogP:	1.81940

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Specification

The Ethyl 7-methylimidazo[1,2-a]pyridine-2-carboxylate, with the cas registry number 70705-33-8, has the systematic name of ethyl 7-methylimidazo[1,2-a]pyridine-2-carboxylate. It belongs to the following product categories: Blocks; Carboxes; Pyridines. And the molecular formula of the chemical is C₁₁H₁₂N₂O₂.

The characteristics of this chemical are as followings: (1)ACD/LogP: 4.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.014; (4)ACD/LogD (pH 7.4): 4.025; (5)ACD/BCF (pH 5.5): 657.995; (6)ACD/BCF (pH 7.4): 675.031; (7)ACD/KOC (pH 5.5): 3594.925; (8)ACD/KOC (pH 7.4): 3688.001; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 43.6 Å²; (13)Index of Refraction: 1.585; (14)Molar Refractivity: 57.02 cm³; (15)Molar Volume: 170.195 cm³; (16)Polarizability: 22.605×10^-24cm³; (17)Surface Tension: 41.952 dyne/cm; (18)Density: 1.2 g/cm³.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: CCOC(=O)c1cn2ccc(cc2n1)C
(2)InChI: InChI=1/C11H12N2O2/c1-3-15-11(14)9-7-13-5-4-8(2)6-10(13)12-9/h4-7H,3H2,1-2H3
(3)InChIKey: AVYYNZWWGNNXRW-UHFFFAOYAY