Methyl N-(2,5-xylyl)carbamate
TL;DR: Methyl N-(2,5-xylyl)carbamate (CAS 20642-88-0) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(2,5-dimethylphenyl)carbamate
Also Known As: METHYL N-(2,5-XYLYL)CARBAMATE, Methyl N-(2,5-dimethylphenyl)carbamate, (2,5-Dimethyl-phenyl)-carbamic acid methyl ester
| Molecular Formula | C10H13NO2 |
|---|---|
| Molecular Weight | 179.09 g/mol |
| LogP | 2.48174 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 179.09464 |
| Heavy Atoms | 13 |
| Complexity | 320.70084 |
Chemical Identifiers
| CAS Number | 20642-88-0 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)NC(=O)OC |
Product Overview
Methyl N-(2,5-xylyl)carbamate (CAS 20642-88-0), with molecular formula C10H13NO2 and molecular weight 179.09 g/mol. IUPAC: methyl N-(2,5-dimethylphenyl)carbamate.
Chemical Property Profile of Methyl N-(2,5-xylyl)carbamate
Property Insights of Methyl N-(2,5-xylyl)carbamate
The XLogP value of 2.48174 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl N-(2,5-xylyl)carbamate. With a topological polar surface area (TPSA) of 38.33 Ų, Methyl N-(2,5-xylyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl N-(2,5-xylyl)carbamate 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 Methyl N-(2,5-xylyl)carbamate?
The CAS number of Methyl N-(2,5-xylyl)carbamate is 20642-88-0.
What is the molecular formula of Methyl N-(2,5-xylyl)carbamate?
The molecular formula of Methyl N-(2,5-xylyl)carbamate is C10H13NO2.
What is the molecular weight of Methyl N-(2,5-xylyl)carbamate?
The molecular weight of Methyl N-(2,5-xylyl)carbamate is 179.09 g/mol.
Where can I buy Methyl N-(2,5-xylyl)carbamate?
You can request a quote for Methyl N-(2,5-xylyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl N-(2,5-xylyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Methyl N-(2,5-xylyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.