N-Cyclohexylaniline
TL;DR: N-Cyclohexylaniline (CAS 1821-36-9) is a chemical compound with molecular formula C12H17N and molecular weight 175.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-cyclohexylaniline
Also Known As: N-Cyclohexylaniline, Benzenamine, N-cyclohexyl-, N-Phenylcyclohexylamine, Cyclohexylphenylamine, Aniline, N-cyclohexyl-
| Molecular Formula | C12H17N |
|---|---|
| Molecular Weight | 175.14 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 175.1361 |
| Heavy Atoms | 13 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 1821-36-9 |
|---|---|
| SMILES | C1CCC(CC1)NC2=CC=CC=C2 |
| InChIKey | TXTHKGMZDDTZFD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Cyclohexylaniline (CAS 1821-36-9), with molecular formula C12H17N and molecular weight 175.14 g/mol. IUPAC: N-cyclohexylaniline.
Chemical Property Profile of N-Cyclohexylaniline
Property Insights of N-Cyclohexylaniline
The XLogP value of 3.7 indicates that N-Cyclohexylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, N-Cyclohexylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Cyclohexylaniline has 1 hydrogen bond donor(s) and 1 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 N-Cyclohexylaniline?
The CAS number of N-Cyclohexylaniline is 1821-36-9.
What is the molecular formula of N-Cyclohexylaniline?
The molecular formula of N-Cyclohexylaniline is C12H17N.
What is the molecular weight of N-Cyclohexylaniline?
The molecular weight of N-Cyclohexylaniline is 175.14 g/mol.
Where can I buy N-Cyclohexylaniline?
You can request a quote for N-Cyclohexylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Cyclohexylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-Cyclohexylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.