Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester)
TL;DR: Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester) (CAS 63716-30-3) is a chemical compound with molecular formula C11H14N2O4 and molecular weight 238.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2,6-dimethyl-4-(methylcarbamoyloxy)phenyl]carbamic acid
Also Known As: Union carbide UC-30044, [2,6-dimethyl-4-(methylcarbamoyloxy)phenyl]carbamic acid, CARBANILIC ACID, 4-HYDROXY-2,6-DIMETHYL-, METHYLCARBAMATE (ESTER), 4-(METHYLCARBAMOYLOXY)-2,6-DIMETHYLCARBANILIC ACID, {2,6-dimethyl-4-[(methylcarbamoyl)oxy]phenyl}carbamic acid
| Molecular Formula | C11H14N2O4 |
|---|---|
| Molecular Weight | 238.10 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.09535 |
| Heavy Atoms | 17 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 63716-30-3 |
|---|---|
| SMILES | CC1=CC(=CC(=C1NC(=O)O)C)OC(=O)NC |
| InChIKey | XPWYTOCLVUTBNX-UHFFFAOYSA-N |
Product Overview
Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester) (CAS 63716-30-3), with molecular formula C11H14N2O4 and molecular weight 238.10 g/mol. IUPAC: [2,6-dimethyl-4-(methylcarbamoyloxy)phenyl]carbamic acid.
Chemical Property Profile of Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester)
Property Insights of Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester)
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester). The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester). Following Lipinski's Rule of Five, Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester) has 3 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, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester)?
The CAS number of Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester) is 63716-30-3.
What is the molecular formula of Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester)?
The molecular formula of Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester) is C11H14N2O4.
What is the molecular weight of Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester)?
The molecular weight of Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester) is 238.10 g/mol.
Where can I buy Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester)?
You can request a quote for Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (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, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester)?
Yes, KEHONG BIO provides custom synthesis services for Carbanilic acid, 4-hydroxy-2,6-dimethyl-, methylcarbamate (ester) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.