Butyl carbanilate
TL;DR: Butyl carbanilate (CAS 1538-74-5) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl N-phenylcarbamate
Also Known As: BUTYL N-PHENYLCARBAMATE, Butyl phenylcarbamate, Butyl carbanilate, Butylphenylurethane, Butyl N-phenylurethane
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.11 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 1538-74-5 |
|---|---|
| SMILES | CCCCOC(=O)NC1=CC=CC=C1 |
| InChIKey | ZTIMKJROOYMUMU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butyl carbanilate (CAS 1538-74-5), with molecular formula C11H15NO2 and molecular weight 193.11 g/mol. IUPAC: butyl N-phenylcarbamate.
Chemical Property Profile of Butyl carbanilate
Property Insights of Butyl carbanilate
The XLogP value of 3.3 indicates that Butyl carbanilate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Butyl carbanilate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl carbanilate 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 carbanilate?
The CAS number of Butyl carbanilate is 1538-74-5.
What is the molecular formula of Butyl carbanilate?
The molecular formula of Butyl carbanilate is C11H15NO2.
What is the molecular weight of Butyl carbanilate?
The molecular weight of Butyl carbanilate is 193.11 g/mol.
Where can I buy Butyl carbanilate?
You can request a quote for Butyl carbanilate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl carbanilate?
Yes, KEHONG BIO provides custom synthesis services for Butyl carbanilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.