Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester
TL;DR: Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester (CAS 89427-19-0) is a chemical compound with molecular formula C11H8Cl2F3N3O2 and molecular weight 340.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5,6-dichloro-2-(trifluoromethyl)-1H-benzimidazol-4-yl] N-ethylcarbamate
Also Known As: Benzimidazol-4-ol, 5,6-dichloro-2-(trifluoromethyl)-, ethylcarbamate, CARBAMIC ACID, ETHYL-, 5,6-DICHLORO-2-(TRIFLUOROMETHYL)-4-BENZIMIDAZOLYL ESTER, [5,6-dichloro-2-(trifluoromethyl)-1H-benzimidazol-4-yl] N-ethylcarbamate, 5,6-Dichloro-2-(trifluoromethyl)-1H-1,3-benzimidazol-4-yl ethylcarbamate, RefChem:332434
| Molecular Formula | C11H8Cl2F3N3O2 |
|---|---|
| Molecular Weight | 340.99 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 67.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 340.99457 |
| Heavy Atoms | 21 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 89427-19-0 |
|---|---|
| SMILES | CCNC(=O)OC1=C2C(=CC(=C1Cl)Cl)NC(=N2)C(F)(F)F |
| InChIKey | YJZWOOIORFWOOU-UHFFFAOYSA-N |
Product Overview
Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester (CAS 89427-19-0), with molecular formula C11H8Cl2F3N3O2 and molecular weight 340.99 g/mol. IUPAC: [5,6-dichloro-2-(trifluoromethyl)-1H-benzimidazol-4-yl] N-ethylcarbamate.
Chemical Property Profile of Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester
Property Insights of Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester
The XLogP value of 3.6 indicates that Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester. Following Lipinski's Rule of Five, Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester?
The CAS number of Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester is 89427-19-0.
What is the molecular formula of Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester?
The molecular formula of Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester is C11H8Cl2F3N3O2.
What is the molecular weight of Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester?
The molecular weight of Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester is 340.99 g/mol.
Where can I buy Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester?
You can request a quote for Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, ethyl-, 5,6-dichloro-2-(trifluoromethyl)-4-benzimidazolyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.