Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate
TL;DR: Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate (CAS 147622-04-6) is a chemical compound with molecular formula C11H11Cl2NO4S and molecular weight 322.97858 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl N-[1-(benzenesulfonyl)-2,2-dichloroethenyl]carbamate
Also Known As: BAS 00093197, ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate, (1-Benzenesulfonyl-2,2-dichloro-vinyl)-carbamic acid ethyl ester, ethyl N-[1-(benzenesulfonyl)-2,2-dichloroethenyl]carbamate
Technical Specifications
| Molecular Formula | C11H11Cl2NO4S |
| Molecular Weight | 322.97858 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 80.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.97858 Da |
| Heavy Atoms | 19 |
| Complexity | 446.0 |
| SMILES | CCOC(=O)NC(=C(Cl)Cl)S(=O)(=O)C1=CC=CC=C1 |
| InChIKey | OTZMVXQQPARVFD-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate
Property Insights of Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate. Following Lipinski's Rule of Five, Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate 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 Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate?
The CAS number of Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate is 147622-04-6.
What is the molecular formula of Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate?
The molecular formula of Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate is C11H11Cl2NO4S.
What is the molecular weight of Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate?
The molecular weight of Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate is 322.97858 g/mol.
Where can I buy Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate?
You can request a quote for Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate?
Yes, CoreyChem provides custom synthesis services for Ethyl 2,2-dichloro-1-(phenylsulfonyl)vinylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.