1-(Phenylamino)cyclohexanecarboxylic acid
TL;DR: 1-(Phenylamino)cyclohexanecarboxylic acid (CAS 87967-38-2) 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-anilinocyclohexane-1-carboxylic acid
Also Known As: 1-(phenylamino)cyclohexanecarboxylic acid, 1-anilinocyclohexanecarboxylic acid, 1-Phenylamino-cyclohexanecarboxylic acid, 1-anilinocyclohexane-1-carboxylic Acid, CHEMBRDG-BB 4140265
| Molecular Formula | C13H17NO2 |
|---|---|
| Molecular Weight | 219.13 g/mol |
| LogP | 2.886 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 219.12593 |
| Heavy Atoms | 16 |
| Complexity | 355.45517 |
Chemical Identifiers
| CAS Number | 87967-38-2 |
|---|---|
| SMILES | C1CCC(CC1)(C(=O)O)NC2=CC=CC=C2 |
Product Overview
1-(Phenylamino)cyclohexanecarboxylic acid (CAS 87967-38-2), with molecular formula C13H17NO2 and molecular weight 219.13 g/mol. IUPAC: 1-anilinocyclohexane-1-carboxylic acid.
Chemical Property Profile of 1-(Phenylamino)cyclohexanecarboxylic acid
Property Insights of 1-(Phenylamino)cyclohexanecarboxylic acid
The XLogP value of 2.886 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Phenylamino)cyclohexanecarboxylic acid. With a topological polar surface area (TPSA) of 49.33 Ų, 1-(Phenylamino)cyclohexanecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Phenylamino)cyclohexanecarboxylic acid has 2 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 1-(Phenylamino)cyclohexanecarboxylic acid?
The CAS number of 1-(Phenylamino)cyclohexanecarboxylic acid is 87967-38-2.
What is the molecular formula of 1-(Phenylamino)cyclohexanecarboxylic acid?
The molecular formula of 1-(Phenylamino)cyclohexanecarboxylic acid is C13H17NO2.
What is the molecular weight of 1-(Phenylamino)cyclohexanecarboxylic acid?
The molecular weight of 1-(Phenylamino)cyclohexanecarboxylic acid is 219.13 g/mol.
Where can I buy 1-(Phenylamino)cyclohexanecarboxylic acid?
You can request a quote for 1-(Phenylamino)cyclohexanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Phenylamino)cyclohexanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(Phenylamino)cyclohexanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.