Benzyl (3-chlorophenyl)carbamate
TL;DR: Benzyl (3-chlorophenyl)carbamate (CAS 22735-54-2) is a chemical compound with molecular formula C14H12ClNO2 and molecular weight 261.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-(3-chlorophenyl)carbamate
Also Known As: benzyl N-(3-chlorophenyl)carbamate, Benzyl (3-chlorophenyl)carbamate, 3-Chlorophenylcarbamic acid benzyl ester, N-(3-chlorophenyl)(phenylmethoxy)carboxamide, J2.407.505B
| Molecular Formula | C14H12ClNO2 |
|---|---|
| Molecular Weight | 261.06 g/mol |
| LogP | 4.0887 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.05566 |
| Heavy Atoms | 18 |
| Complexity | 528.327 |
Chemical Identifiers
| CAS Number | 22735-54-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC(=O)NC2=CC(=CC=C2)Cl |
Product Overview
Benzyl (3-chlorophenyl)carbamate (CAS 22735-54-2), with molecular formula C14H12ClNO2 and molecular weight 261.06 g/mol. IUPAC: benzyl N-(3-chlorophenyl)carbamate.
Chemical Property Profile of Benzyl (3-chlorophenyl)carbamate
Property Insights of Benzyl (3-chlorophenyl)carbamate
The XLogP value of 4.0887 indicates that Benzyl (3-chlorophenyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, Benzyl (3-chlorophenyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzyl (3-chlorophenyl)carbamate 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 Benzyl (3-chlorophenyl)carbamate?
The CAS number of Benzyl (3-chlorophenyl)carbamate is 22735-54-2.
What is the molecular formula of Benzyl (3-chlorophenyl)carbamate?
The molecular formula of Benzyl (3-chlorophenyl)carbamate is C14H12ClNO2.
What is the molecular weight of Benzyl (3-chlorophenyl)carbamate?
The molecular weight of Benzyl (3-chlorophenyl)carbamate is 261.06 g/mol.
Where can I buy Benzyl (3-chlorophenyl)carbamate?
You can request a quote for Benzyl (3-chlorophenyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl (3-chlorophenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Benzyl (3-chlorophenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.