1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate
TL;DR: 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate (CAS 533-06-2) is a chemical compound with molecular formula C11H15NO4 and molecular weight 225.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-hydroxy-3-(2-methylphenoxy)propyl] carbamate
Also Known As: Mephenesin carbamate, Tolseram, Kimavoxyl, 2-Hydroxy-3-(o-tolyloxy)propyl carbamate, MC 2303
| Molecular Formula | C11H15NO4 |
|---|---|
| Molecular Weight | 225.10 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 81.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 225.10011 |
| Heavy Atoms | 16 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 533-06-2 |
|---|---|
| SMILES | CC1=CC=CC=C1OCC(COC(=O)N)O |
| InChIKey | KRPAJLYSLFNDOA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate (CAS 533-06-2), with molecular formula C11H15NO4 and molecular weight 225.10 g/mol. IUPAC: [2-hydroxy-3-(2-methylphenoxy)propyl] carbamate.
Chemical Property Profile of 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate
Property Insights of 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate. The TPSA of 81.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate. Following Lipinski's Rule of Five, 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate has 2 hydrogen bond donor(s) and 4 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 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate?
The CAS number of 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate is 533-06-2.
What is the molecular formula of 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate?
The molecular formula of 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate is C11H15NO4.
What is the molecular weight of 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate?
The molecular weight of 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate is 225.10 g/mol.
Where can I buy 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate?
You can request a quote for 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Propanediol, 3-(2-methylphenoxy)-, 1-carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.