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| CAS No.: | 57626-37-6 |
|---|---|
| Name: | Ethyl 3-methyl-imidazo[2,1-b]thiazole 4-carboxylate |
| Molecular Structure: | |
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| Formula: | C9H10N2O2S |
| Molecular Weight: | 210.257 |
| Synonyms: | Ethyl 6-methylimidazo[2,1-b][1,3]thiazole-5-carboxylate;6-Methyl-imidazo[2,1-b]thiazole-5-carboxylic acid ethyl ester;Imidazo[2,1-b]thiazole-5-carboxylic acid, 6-methyl-, ethyl ester;Ethyl 6-methylimidazo[2,1-b]thiazole-5-carboxylate;BAS 00602579;AC1LDOF3;AC1Q32ML; |
| Density: | 1.37 g/cm3 |
| Melting Point: | 98 °C |
| PSA: | 71.84000 |
| LogP: | 1.88090 |
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- Total:31 Page 1 of 1 1
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Specification
The Ethyl 3-methyl-imidazo[2,1-b]thiazole 4-carboxylate with CAS registry number of 57626-37-6 is also known as 6-Methyl-imidazo[2,1-b]thiazole-5-carboxylic acid ethyl ester. The IUPAC name is Ethyl 6-methylimidazo[2,1-b][1,3]thiazole-5-carboxylate. In addition, the formula is C9H10N2O2S and the molecular weight is 210.25.
Physical properties about Ethyl 3-methyl-imidazo[2,1-b]thiazole 4-carboxylate are: (1)ACD/LogP: 3.40; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 71.84Å2; (7)Index of Refraction: 1.649; (8)Molar Refractivity: 55.61 cm3; (9)Molar Volume: 152.4 cm3; (10)Polarizability: 22.04×10-24cm3; (11)Surface Tension: 49.9 dyne/cm; (12)Density: 1.37 g/cm3.
You can still convert the following datas into molecular structure:
1. Canonical SMILES: CCOC(=O)C1=C(N=C2N1C=CS2)C
2. InChI: InChI=1S/C9H10N2O2S/c1-3-13-8(12)7-6(2)10-9-11(7)4-5-14-9/h4-5H,3H2,1-2H3
3. InChIKey: NSUFDDBQLKSSIN-UHFFFAOYSA-N