Ethyl benzylcarbamate
TL;DR: Ethyl benzylcarbamate (CAS 2621-78-5) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl N-benzylcarbamate
Also Known As: Ethyl benzylcarbamate, Ethyl N-benzylcarbamate, benzylurethane, Benzylurethan, ETHYL-N-BENZYLCARBAMATE
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H13NO2 |
| Molecular Weight | 179.09464 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 179.09464 Da |
| Heavy Atoms | 13 |
| Complexity | 153.0 |
| SMILES | CCOC(=O)NCC1=CC=CC=C1 |
| InChIKey | XSXLCQLOFRENHC-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl benzylcarbamate
Property Insights of Ethyl benzylcarbamate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl benzylcarbamate. With a topological polar surface area (TPSA) of 38.3 Ų, Ethyl benzylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl benzylcarbamate has 1 hydrogen bond donor(s) and 2 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 benzylcarbamate?
The CAS number of Ethyl benzylcarbamate is 2621-78-5.
What is the molecular formula of Ethyl benzylcarbamate?
The molecular formula of Ethyl benzylcarbamate is C10H13NO2.
What is the molecular weight of Ethyl benzylcarbamate?
The molecular weight of Ethyl benzylcarbamate is 179.09464 g/mol.
Where can I buy Ethyl benzylcarbamate?
You can request a quote for Ethyl benzylcarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl benzylcarbamate?
Yes, CoreyChem provides custom synthesis services for Ethyl benzylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.