1-Amino-2-phenylcyclohexanecarboxylic acid
TL;DR: 1-Amino-2-phenylcyclohexanecarboxylic acid (CAS 50719-31-8) is a chemical compound with molecular formula C13H17NO2 and molecular weight 219.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-2-phenylcyclohexane-1-carboxylic acid
Also Known As: 1-Amino-2-phenylcyclohexanecarboxylic acid, NCIOpen2_004035, 1-amino-2-phenylcyclohexane-1-carboxylic acid, 1-amino-2-phenyl-1-cyclohexanecarboxylic, 1-amino-2-phenyl-cyclohexanecarboxylic acid
| Molecular Formula | C13H17NO2 |
|---|---|
| Molecular Weight | 219.13 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.12593 |
| Heavy Atoms | 16 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 50719-31-8 |
|---|---|
| SMILES | C1CCC(C(C1)C2=CC=CC=C2)(C(=O)O)N |
| InChIKey | QAKNRGSEJPUFDI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Amino-2-phenylcyclohexanecarboxylic acid (CAS 50719-31-8), with molecular formula C13H17NO2 and molecular weight 219.13 g/mol. IUPAC: 1-amino-2-phenylcyclohexane-1-carboxylic acid.
Chemical Property Profile of 1-Amino-2-phenylcyclohexanecarboxylic acid
Property Insights of 1-Amino-2-phenylcyclohexanecarboxylic acid
The XLogP value of -0.4 indicates that 1-Amino-2-phenylcyclohexanecarboxylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Amino-2-phenylcyclohexanecarboxylic acid. Following Lipinski's Rule of Five, 1-Amino-2-phenylcyclohexanecarboxylic acid has 2 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 1-Amino-2-phenylcyclohexanecarboxylic acid?
The CAS number of 1-Amino-2-phenylcyclohexanecarboxylic acid is 50719-31-8.
What is the molecular formula of 1-Amino-2-phenylcyclohexanecarboxylic acid?
The molecular formula of 1-Amino-2-phenylcyclohexanecarboxylic acid is C13H17NO2.
What is the molecular weight of 1-Amino-2-phenylcyclohexanecarboxylic acid?
The molecular weight of 1-Amino-2-phenylcyclohexanecarboxylic acid is 219.13 g/mol.
Where can I buy 1-Amino-2-phenylcyclohexanecarboxylic acid?
You can request a quote for 1-Amino-2-phenylcyclohexanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Amino-2-phenylcyclohexanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-Amino-2-phenylcyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.