Carbamic acid, (3,4-dimethylphenyl)-, methyl ester
TL;DR: Carbamic acid, (3,4-dimethylphenyl)-, methyl ester (CAS 20642-87-9) 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-(3,4-dimethylphenyl)carbamate
Also Known As: methyl N-(3,4-dimethylphenyl)carbamate, methyl 3,4-dimethylphenylcarbamate, methyl (3,4-dimethylphenyl)carbamate, Potassium hydrogen diformate (KHF), Carbamic acid, (3,4-dimethylphenyl)-, 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 | 20642-87-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)OC)C |
Product Overview
Carbamic acid, (3,4-dimethylphenyl)-, methyl ester (CAS 20642-87-9), with molecular formula C10H13NO2 and molecular weight 179.09 g/mol. IUPAC: methyl N-(3,4-dimethylphenyl)carbamate.
Chemical Property Profile of Carbamic acid, (3,4-dimethylphenyl)-, methyl ester
Property Insights of Carbamic acid, (3,4-dimethylphenyl)-, methyl ester
The XLogP value of 2.48174 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, (3,4-dimethylphenyl)-, methyl ester. With a topological polar surface area (TPSA) of 38.33 Ų, Carbamic acid, (3,4-dimethylphenyl)-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, (3,4-dimethylphenyl)-, methyl 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, (3,4-dimethylphenyl)-, methyl ester?
The CAS number of Carbamic acid, (3,4-dimethylphenyl)-, methyl ester is 20642-87-9.
What is the molecular formula of Carbamic acid, (3,4-dimethylphenyl)-, methyl ester?
The molecular formula of Carbamic acid, (3,4-dimethylphenyl)-, methyl ester is C10H13NO2.
What is the molecular weight of Carbamic acid, (3,4-dimethylphenyl)-, methyl ester?
The molecular weight of Carbamic acid, (3,4-dimethylphenyl)-, methyl ester is 179.09 g/mol.
Where can I buy Carbamic acid, (3,4-dimethylphenyl)-, methyl ester?
You can request a quote for Carbamic acid, (3,4-dimethylphenyl)-, methyl 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, (3,4-dimethylphenyl)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, (3,4-dimethylphenyl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.