2-(1-Phenylcyclohexyl)acetonitrile
TL;DR: 2-(1-Phenylcyclohexyl)acetonitrile (CAS 32294-72-7) is a chemical compound with molecular formula C14H17N and molecular weight 199.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-phenylcyclohexyl)acetonitrile
Also Known As: 2-(1-phenylcyclohexyl)acetonitrile, Cyclohexaneacetonitrile,1-phenyl, (1-Phenylcyclohexyl)acetonitrile, Cyclohexaneacetonitrile, 1-phenyl-, (1-phenyl-cyclohexyl)-acetonitrile
| Molecular Formula | C14H17N |
|---|---|
| Molecular Weight | 199.14 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 23.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.1361 |
| Heavy Atoms | 15 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 32294-72-7 |
|---|---|
| SMILES | C1CCC(CC1)(CC#N)C2=CC=CC=C2 |
| InChIKey | QTZSJWWGPBHVRZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(1-Phenylcyclohexyl)acetonitrile (CAS 32294-72-7), with molecular formula C14H17N and molecular weight 199.14 g/mol. IUPAC: 2-(1-phenylcyclohexyl)acetonitrile.
Chemical Property Profile of 2-(1-Phenylcyclohexyl)acetonitrile
Property Insights of 2-(1-Phenylcyclohexyl)acetonitrile
The XLogP value of 4.2 indicates that 2-(1-Phenylcyclohexyl)acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.8 Ų, 2-(1-Phenylcyclohexyl)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Phenylcyclohexyl)acetonitrile has 0 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 2-(1-Phenylcyclohexyl)acetonitrile?
The CAS number of 2-(1-Phenylcyclohexyl)acetonitrile is 32294-72-7.
What is the molecular formula of 2-(1-Phenylcyclohexyl)acetonitrile?
The molecular formula of 2-(1-Phenylcyclohexyl)acetonitrile is C14H17N.
What is the molecular weight of 2-(1-Phenylcyclohexyl)acetonitrile?
The molecular weight of 2-(1-Phenylcyclohexyl)acetonitrile is 199.14 g/mol.
Where can I buy 2-(1-Phenylcyclohexyl)acetonitrile?
You can request a quote for 2-(1-Phenylcyclohexyl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Phenylcyclohexyl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Phenylcyclohexyl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.