Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester
TL;DR: Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester (CAS 108442-61-1) is a chemical compound with molecular formula C9H10N2O2S and molecular weight 210.0463 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl N-(3-cyano-4,5-dimethylthiophen-2-yl)carbamate
Also Known As: Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester, methyl N-(3-cyano-4,5-dimethylthiophen-2-yl)carbamate, Methyl (3-cyano-4,5-dimethylthiophen-2-yl)carbamate, Methyl N-(3-cyano-4,5-dimethyl-thiophen-2-yl)carbamate
Technical Specifications
| Molecular Formula | C9H10N2O2S |
| Molecular Weight | 210.0463 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 90.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.0463 Da |
| Heavy Atoms | 14 |
| Complexity | 273.0 |
| SMILES | CC1=C(SC(=C1C#N)NC(=O)OC)C |
| InChIKey | PNZXIDNGTHFGSD-UHFFFAOYSA-N |
Chemical Property Profile of Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester
Property Insights of Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester. The TPSA of 90.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester. Following Lipinski's Rule of Five, Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester?
The CAS number of Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester is 108442-61-1.
What is the molecular formula of Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester?
The molecular formula of Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester is C9H10N2O2S.
What is the molecular weight of Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester?
The molecular weight of Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester is 210.0463 g/mol.
Where can I buy Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester?
You can request a quote for Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester?
Yes, CoreyChem provides custom synthesis services for Carbamic acid, (3-cyano-4,5-dimethyl-2-thienyl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.