2-Phenoxyethyl methylcarbamate
TL;DR: 2-Phenoxyethyl methylcarbamate (CAS 21998-12-9) is a chemical compound with molecular formula C10H13NO3 and molecular weight 195.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenoxyethyl N-methylcarbamate
Also Known As: 2-Phenoxyethyl methylcarbamate, 2-phenoxyethyl N-methylcarbamate, methyl 4-(methylcarbamoyloxy)benzoate, Ethanol, 2-phenoxy-,1-(N-methylcarbamate), CARBAMIC ACID, METHYL-, 2-PHENOXYETHYL ESTER
| Molecular Formula | C10H13NO3 |
|---|---|
| Molecular Weight | 195.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 195.08954 |
| Heavy Atoms | 14 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 21998-12-9 |
|---|---|
| SMILES | CNC(=O)OCCOC1=CC=CC=C1 |
| InChIKey | XWYAEJCEJFWSNX-UHFFFAOYSA-N |
Product Overview
2-Phenoxyethyl methylcarbamate (CAS 21998-12-9), with molecular formula C10H13NO3 and molecular weight 195.09 g/mol. IUPAC: 2-phenoxyethyl N-methylcarbamate.
Chemical Property Profile of 2-Phenoxyethyl methylcarbamate
Property Insights of 2-Phenoxyethyl methylcarbamate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phenoxyethyl methylcarbamate. With a topological polar surface area (TPSA) of 47.6 Ų, 2-Phenoxyethyl methylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenoxyethyl methylcarbamate has 1 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 2-Phenoxyethyl methylcarbamate?
The CAS number of 2-Phenoxyethyl methylcarbamate is 21998-12-9.
What is the molecular formula of 2-Phenoxyethyl methylcarbamate?
The molecular formula of 2-Phenoxyethyl methylcarbamate is C10H13NO3.
What is the molecular weight of 2-Phenoxyethyl methylcarbamate?
The molecular weight of 2-Phenoxyethyl methylcarbamate is 195.09 g/mol.
Where can I buy 2-Phenoxyethyl methylcarbamate?
You can request a quote for 2-Phenoxyethyl methylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenoxyethyl methylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenoxyethyl methylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.