Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester)
TL;DR: Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester) (CAS 19961-92-3) is a chemical compound with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[methoxycarbonyl(methyl)amino]phenyl] N,N-dimethylcarbamate
Also Known As: CARBANILIC ACID, m-HYDROXY-N-METHYL-, METHYL ESTER, DIMETHYLCARBAMATE (ester), Methyl m-hydroxy-N-methylcarbanilate, dimethylcarbamate, m-Hydroxy-N-methylcarbanilic acid methyl ester dimethylcarbamate, Carbanilic acid, methyl ester, dimethylcarbamate, Methyl m-hydroxy-N-methylcarbanilate dimethylcarbamate
| Molecular Formula | C12H16N2O4 |
|---|---|
| Molecular Weight | 252.11 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.11101 |
| Heavy Atoms | 18 |
| Complexity | 306.0 |
Chemical Identifiers
| CAS Number | 19961-92-3 |
|---|---|
| SMILES | CN(C)C(=O)OC1=CC=CC(=C1)N(C)C(=O)OC |
| InChIKey | NRUBYAXMLCSEJN-UHFFFAOYSA-N |
Product Overview
Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester) (CAS 19961-92-3), with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol. IUPAC: [3-[methoxycarbonyl(methyl)amino]phenyl] N,N-dimethylcarbamate.
Chemical Property Profile of Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester)
Property Insights of Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester)
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester). With a topological polar surface area (TPSA) of 59.1 Ų, Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester) has 0 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 Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester)?
The CAS number of Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester) is 19961-92-3.
What is the molecular formula of Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester)?
The molecular formula of Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester) is C12H16N2O4.
What is the molecular weight of Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester)?
The molecular weight of Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester) is 252.11 g/mol.
Where can I buy Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester)?
You can request a quote for Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester)?
Yes, KEHONG BIO provides custom synthesis services for Carbanilic acid, m-hydroxy-N-methyl-, methyl ester, dimethylcarbamate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.