2-bromoethyl N-phenylcarbamate
TL;DR: 2-bromoethyl N-phenylcarbamate (CAS 32353-12-1) is a chemical compound with molecular formula C9H10BrNO2 and molecular weight 242.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromoethyl N-phenylcarbamate
Also Known As: 2-bromoethyl N-phenylcarbamate, 2-Bromoethyl phenylcarbamate, 2-Bromoethylphenylcarbamate, Ethanol, 2-bromo-, phenylcarbamate, 666-500-1
| Molecular Formula | C9H10BrNO2 |
|---|---|
| Molecular Weight | 242.99 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.98949 |
| Heavy Atoms | 13 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 32353-12-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)OCCBr |
| InChIKey | QVXXUDSODOZFNA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-bromoethyl N-phenylcarbamate (CAS 32353-12-1), with molecular formula C9H10BrNO2 and molecular weight 242.99 g/mol. IUPAC: 2-bromoethyl N-phenylcarbamate.
Chemical Property Profile of 2-bromoethyl N-phenylcarbamate
Property Insights of 2-bromoethyl N-phenylcarbamate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-bromoethyl N-phenylcarbamate. With a topological polar surface area (TPSA) of 38.3 Ų, 2-bromoethyl N-phenylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-bromoethyl N-phenylcarbamate 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
Frequently Asked Questions
What is the CAS number of 2-bromoethyl N-phenylcarbamate?
The CAS number of 2-bromoethyl N-phenylcarbamate is 32353-12-1.
What is the molecular formula of 2-bromoethyl N-phenylcarbamate?
The molecular formula of 2-bromoethyl N-phenylcarbamate is C9H10BrNO2.
What is the molecular weight of 2-bromoethyl N-phenylcarbamate?
The molecular weight of 2-bromoethyl N-phenylcarbamate is 242.99 g/mol.
Where can I buy 2-bromoethyl N-phenylcarbamate?
You can request a quote for 2-bromoethyl N-phenylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-bromoethyl N-phenylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 2-bromoethyl N-phenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.