Cyclohexanone, 2-(2-propen-1-yl)-
TL;DR: Cyclohexanone, 2-(2-propen-1-yl)- (CAS 94-66-6) is a chemical compound with molecular formula C9H14O and molecular weight 138.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-prop-2-enylcyclohexan-1-one
Also Known As: 2-Allylcyclohexanone, 2-Allylcyclohexan-1-one, Cyclohexanone, 2-allyl-, Cyclohexanone, 2-(2-propenyl)-, 2-(2-Propenyl)cyclohexanone
| Molecular Formula | C9H14O |
|---|---|
| Molecular Weight | 138.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 138.10446 |
| Heavy Atoms | 10 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 94-66-6 |
|---|---|
| SMILES | C=CCC1CCCCC1=O |
| InChIKey | UPGHEUSRLZSXAE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclohexanone, 2-(2-propen-1-yl)- (CAS 94-66-6), with molecular formula C9H14O and molecular weight 138.10 g/mol. IUPAC: 2-prop-2-enylcyclohexan-1-one.
Chemical Property Profile of Cyclohexanone, 2-(2-propen-1-yl)-
Property Insights of Cyclohexanone, 2-(2-propen-1-yl)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclohexanone, 2-(2-propen-1-yl)-. With a topological polar surface area (TPSA) of 17.1 Ų, Cyclohexanone, 2-(2-propen-1-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexanone, 2-(2-propen-1-yl)- 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-(2-propen-1-yl)-?
The CAS number of Cyclohexanone, 2-(2-propen-1-yl)- is 94-66-6.
What is the molecular formula of Cyclohexanone, 2-(2-propen-1-yl)-?
The molecular formula of Cyclohexanone, 2-(2-propen-1-yl)- is C9H14O.
What is the molecular weight of Cyclohexanone, 2-(2-propen-1-yl)-?
The molecular weight of Cyclohexanone, 2-(2-propen-1-yl)- is 138.10 g/mol.
Where can I buy Cyclohexanone, 2-(2-propen-1-yl)-?
You can request a quote for Cyclohexanone, 2-(2-propen-1-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexanone, 2-(2-propen-1-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexanone, 2-(2-propen-1-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.