Butyl N-(4-chlorophenyl)carbamate
TL;DR: Butyl N-(4-chlorophenyl)carbamate (CAS 5816-35-3) is a chemical compound with molecular formula C11H14ClNO2 and molecular weight 227.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl N-(4-chlorophenyl)carbamate
Also Known As: butyl N-(4-chlorophenyl)carbamate, butyl (4-chlorophenyl)carbamate, butoxy-N-(4-chlorophenyl)carboxamide, (4-Chlorophenyl)carbamic acid butyl ester, N-(4-Chlorophenyl)carbamic acid butyl ester
| Molecular Formula | C11H14ClNO2 |
|---|---|
| Molecular Weight | 227.07 g/mol |
| LogP | 3.6886 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 227.0713 |
| Heavy Atoms | 15 |
| Complexity | 310.8689 |
Chemical Identifiers
| CAS Number | 5816-35-3 |
|---|---|
| SMILES | CCCCOC(=O)NC1=CC=C(C=C1)Cl |
Product Overview
Butyl N-(4-chlorophenyl)carbamate (CAS 5816-35-3), with molecular formula C11H14ClNO2 and molecular weight 227.07 g/mol. IUPAC: butyl N-(4-chlorophenyl)carbamate.
Chemical Property Profile of Butyl N-(4-chlorophenyl)carbamate
Property Insights of Butyl N-(4-chlorophenyl)carbamate
The XLogP value of 3.6886 indicates that Butyl N-(4-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, Butyl N-(4-chlorophenyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl N-(4-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 Butyl N-(4-chlorophenyl)carbamate?
The CAS number of Butyl N-(4-chlorophenyl)carbamate is 5816-35-3.
What is the molecular formula of Butyl N-(4-chlorophenyl)carbamate?
The molecular formula of Butyl N-(4-chlorophenyl)carbamate is C11H14ClNO2.
What is the molecular weight of Butyl N-(4-chlorophenyl)carbamate?
The molecular weight of Butyl N-(4-chlorophenyl)carbamate is 227.07 g/mol.
Where can I buy Butyl N-(4-chlorophenyl)carbamate?
You can request a quote for Butyl N-(4-chlorophenyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl N-(4-chlorophenyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Butyl N-(4-chlorophenyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.