Cyclohexanone, 2-p-chlorobenzyl-
TL;DR: Cyclohexanone, 2-p-chlorobenzyl- (CAS 2702-79-6) is a chemical compound with molecular formula C13H15ClO and molecular weight 222.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methyl]cyclohexan-1-one
Also Known As: 2-p-Chlorobenzylcyclohexanone, Cyclohexanone, 2-p-chlorobenzyl-, 2-(p-Chlorobenzyl)cyclohexanone, 2-[(4-chlorophenyl)methyl]cyclohexan-1-one, Cyclohexanone, 2-((4-chlorophenyl)methyl)-
| Molecular Formula | C13H15ClO |
|---|---|
| Molecular Weight | 222.08 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.08115 |
| Heavy Atoms | 15 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 2702-79-6 |
|---|---|
| SMILES | C1CCC(=O)C(C1)CC2=CC=C(C=C2)Cl |
| InChIKey | UNJQQZUSORSFMS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclohexanone, 2-p-chlorobenzyl- (CAS 2702-79-6), with molecular formula C13H15ClO and molecular weight 222.08 g/mol. IUPAC: 2-[(4-chlorophenyl)methyl]cyclohexan-1-one.
Chemical Property Profile of Cyclohexanone, 2-p-chlorobenzyl-
Property Insights of Cyclohexanone, 2-p-chlorobenzyl-
The XLogP value of 3.6 indicates that Cyclohexanone, 2-p-chlorobenzyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Cyclohexanone, 2-p-chlorobenzyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexanone, 2-p-chlorobenzyl- 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 Cyclohexanone, 2-p-chlorobenzyl-?
The CAS number of Cyclohexanone, 2-p-chlorobenzyl- is 2702-79-6.
What is the molecular formula of Cyclohexanone, 2-p-chlorobenzyl-?
The molecular formula of Cyclohexanone, 2-p-chlorobenzyl- is C13H15ClO.
What is the molecular weight of Cyclohexanone, 2-p-chlorobenzyl-?
The molecular weight of Cyclohexanone, 2-p-chlorobenzyl- is 222.08 g/mol.
Where can I buy Cyclohexanone, 2-p-chlorobenzyl-?
You can request a quote for Cyclohexanone, 2-p-chlorobenzyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexanone, 2-p-chlorobenzyl-?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexanone, 2-p-chlorobenzyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.