2-Aminobenzoic acid 4-methylcyclohexyl ester
TL;DR: 2-Aminobenzoic acid 4-methylcyclohexyl ester (CAS 56298-94-3) is a chemical compound with molecular formula C14H19NO2 and molecular weight 233.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylcyclohexyl) 2-aminobenzoate
Also Known As: 4-Methylcyclohexyl 2-aminobenzoate, (4-methylcyclohexyl) 2-aminobenzoate, 2-Aminobenzoic acid 4-methylcyclohexyl ester, 4-Methylcyclohexyl 2-aminobenzoate #, Benzoic acid, 2-amino-, 4-methylcyclohexyl ester
| Molecular Formula | C14H19NO2 |
|---|---|
| Molecular Weight | 233.14 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.14159 |
| Heavy Atoms | 17 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 56298-94-3 |
|---|---|
| SMILES | CC1CCC(CC1)OC(=O)C2=CC=CC=C2N |
| InChIKey | OUJCGMWEBUSDIW-UHFFFAOYSA-N |
Product Overview
2-Aminobenzoic acid 4-methylcyclohexyl ester (CAS 56298-94-3), with molecular formula C14H19NO2 and molecular weight 233.14 g/mol. IUPAC: (4-methylcyclohexyl) 2-aminobenzoate.
Chemical Property Profile of 2-Aminobenzoic acid 4-methylcyclohexyl ester
Property Insights of 2-Aminobenzoic acid 4-methylcyclohexyl ester
The XLogP value of 3.9 indicates that 2-Aminobenzoic acid 4-methylcyclohexyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, 2-Aminobenzoic acid 4-methylcyclohexyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Aminobenzoic acid 4-methylcyclohexyl ester 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-Aminobenzoic acid 4-methylcyclohexyl ester?
The CAS number of 2-Aminobenzoic acid 4-methylcyclohexyl ester is 56298-94-3.
What is the molecular formula of 2-Aminobenzoic acid 4-methylcyclohexyl ester?
The molecular formula of 2-Aminobenzoic acid 4-methylcyclohexyl ester is C14H19NO2.
What is the molecular weight of 2-Aminobenzoic acid 4-methylcyclohexyl ester?
The molecular weight of 2-Aminobenzoic acid 4-methylcyclohexyl ester is 233.14 g/mol.
Where can I buy 2-Aminobenzoic acid 4-methylcyclohexyl ester?
You can request a quote for 2-Aminobenzoic acid 4-methylcyclohexyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Aminobenzoic acid 4-methylcyclohexyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Aminobenzoic acid 4-methylcyclohexyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.