2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)-
TL;DR: 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)- (CAS 5113-66-6) is a chemical compound with molecular formula C10H16O and molecular weight 152.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2-propan-2-ylcyclohex-2-en-1-one
Also Known As: p-Menth-4-en-3-one, 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)-, c1068, 2-isopropyl-5-methylcyclohex-2-enone, 5-methyl-2-propan-2-ylcyclohex-2-en-1-one
| Molecular Formula | C10H16O |
|---|---|
| Molecular Weight | 152.12 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 152.12012 |
| Heavy Atoms | 11 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 5113-66-6 |
|---|---|
| SMILES | CC1CC=C(C(=O)C1)C(C)C |
| InChIKey | OAYBZGPDRAMDNF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)- (CAS 5113-66-6), with molecular formula C10H16O and molecular weight 152.12 g/mol. IUPAC: 5-methyl-2-propan-2-ylcyclohex-2-en-1-one.
Chemical Property Profile of 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)-
Property Insights of 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)-. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)- 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-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)-?
The CAS number of 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)- is 5113-66-6.
What is the molecular formula of 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)-?
The molecular formula of 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)- is C10H16O.
What is the molecular weight of 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)-?
The molecular weight of 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)- is 152.12 g/mol.
Where can I buy 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)-?
You can request a quote for 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyclohexen-1-one, 5-methyl-2-(1-methylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.