Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester
TL;DR: Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester (CAS 27898-06-2) is a chemical compound with molecular formula C10H12ClNO3 and molecular weight 229.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl N-(5-chloro-2-hydroxyphenyl)carbamate
Also Known As: 2-Hydroxychlorpropham, Isopropyl-5-chlor-2-hydroxycarbanilat, Isopropyl 5-chloro-2-hydroxycarbanilate, Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester, 1-Methylethyl (5-chloro-2-hydroxyphenyl)carbamate
| Molecular Formula | C10H12ClNO3 |
|---|---|
| Molecular Weight | 229.05 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 229.05057 |
| Heavy Atoms | 15 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 27898-06-2 |
|---|---|
| SMILES | CC(C)OC(=O)NC1=C(C=CC(=C1)Cl)O |
| InChIKey | UMISYNRSBYIDTJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester (CAS 27898-06-2), with molecular formula C10H12ClNO3 and molecular weight 229.05 g/mol. IUPAC: propan-2-yl N-(5-chloro-2-hydroxyphenyl)carbamate.
Chemical Property Profile of Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester
Property Insights of Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester. With a topological polar surface area (TPSA) of 58.6 Ų, Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester has 2 hydrogen bond donor(s) and 3 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, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester?
The CAS number of Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester is 27898-06-2.
What is the molecular formula of Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester?
The molecular formula of Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester is C10H12ClNO3.
What is the molecular weight of Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester?
The molecular weight of Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester is 229.05 g/mol.
Where can I buy Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester?
You can request a quote for Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl 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, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, (5-chloro-2-hydroxyphenyl)-, 1-methylethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.