Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester
TL;DR: Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester (CAS 62064-73-7) is a chemical compound with molecular formula C13H16F3NO3 and molecular weight 291.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[2-methoxy-2-[3-(trifluoromethyl)phenyl]ethyl]carbamate
Also Known As: N-(beta-Methoxy-m-trifluoromethylphenethyl)carbamic acid ethyl ester, ethyl N-[2-methoxy-2-[3-(trifluoromethyl)phenyl]ethyl]carbamate, CARBAMIC ACID, N-(beta-METHOXY-m-TRIFLUOROMETHYLPHENETHYL)-, ETHYL ESTER, Ethyl hydrogen {2-methoxy-2-[3-(trifluoromethyl)phenyl]ethyl}carbonimidate, ETHYL N-{2-METHOXY-2-[3-(TRIFLUOROMETHYL)PHENYL]ETHYL}CARBAMATE
| Molecular Formula | C13H16F3NO3 |
|---|---|
| Molecular Weight | 291.11 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 291.10822 |
| Heavy Atoms | 20 |
| Complexity | 310.0 |
Chemical Identifiers
| CAS Number | 62064-73-7 |
|---|---|
| SMILES | CCOC(=O)NCC(C1=CC(=CC=C1)C(F)(F)F)OC |
| InChIKey | HGVPRYBOGXQZDU-UHFFFAOYSA-N |
Product Overview
Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester (CAS 62064-73-7), with molecular formula C13H16F3NO3 and molecular weight 291.11 g/mol. IUPAC: ethyl N-[2-methoxy-2-[3-(trifluoromethyl)phenyl]ethyl]carbamate.
Chemical Property Profile of Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester
Property Insights of Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester. With a topological polar surface area (TPSA) of 47.6 Ų, Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester has 1 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, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester?
The CAS number of Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester is 62064-73-7.
What is the molecular formula of Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester?
The molecular formula of Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester is C13H16F3NO3.
What is the molecular weight of Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester?
The molecular weight of Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester is 291.11 g/mol.
Where can I buy Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester?
You can request a quote for Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl 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, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, N-(beta-methoxy-m-trifluoromethylphenethyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.