Carbamic acid, 3-chlorophenyl-, isobutyl ester
TL;DR: Carbamic acid, 3-chlorophenyl-, isobutyl ester (CAS 92316-49-9) 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.
2-methylpropyl N-(3-chlorophenyl)carbamate
Also Known As: 2-methylpropyl N-(3-chlorophenyl)carbamate, Carbanilic acid, m-chloro-, isobutyl ester, Carbamic acid, 3-chlorophenyl-, isobutyl ester
| Molecular Formula | C11H14ClNO2 |
|---|---|
| Molecular Weight | 227.07 g/mol |
| LogP | 3.5445 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.0713 |
| Heavy Atoms | 15 |
| Complexity | 339.11475 |
Chemical Identifiers
| CAS Number | 92316-49-9 |
|---|---|
| SMILES | CC(C)COC(=O)NC1=CC(=CC=C1)Cl |
Product Overview
Carbamic acid, 3-chlorophenyl-, isobutyl ester (CAS 92316-49-9), with molecular formula C11H14ClNO2 and molecular weight 227.07 g/mol. IUPAC: 2-methylpropyl N-(3-chlorophenyl)carbamate.
Chemical Property Profile of Carbamic acid, 3-chlorophenyl-, isobutyl ester
Property Insights of Carbamic acid, 3-chlorophenyl-, isobutyl ester
The XLogP value of 3.5445 indicates that Carbamic acid, 3-chlorophenyl-, isobutyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, Carbamic acid, 3-chlorophenyl-, isobutyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, 3-chlorophenyl-, isobutyl ester 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 Carbamic acid, 3-chlorophenyl-, isobutyl ester?
The CAS number of Carbamic acid, 3-chlorophenyl-, isobutyl ester is 92316-49-9.
What is the molecular formula of Carbamic acid, 3-chlorophenyl-, isobutyl ester?
The molecular formula of Carbamic acid, 3-chlorophenyl-, isobutyl ester is C11H14ClNO2.
What is the molecular weight of Carbamic acid, 3-chlorophenyl-, isobutyl ester?
The molecular weight of Carbamic acid, 3-chlorophenyl-, isobutyl ester is 227.07 g/mol.
Where can I buy Carbamic acid, 3-chlorophenyl-, isobutyl ester?
You can request a quote for Carbamic acid, 3-chlorophenyl-, isobutyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, 3-chlorophenyl-, isobutyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, 3-chlorophenyl-, isobutyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.