4-Isobornyl-2-methylcyclohexan-1-one
TL;DR: 4-Isobornyl-2-methylcyclohexan-1-one (CAS 63779-21-5) is a chemical compound with molecular formula C17H28O and molecular weight 248.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-4-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)cyclohexan-1-one
Also Known As: 4-Isobornyl-2-methylcyclohexan-1-one, EINECS 264-458-5, 2-methyl-4-(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)cyclohexan-1-one, 2-Methyl-4-(1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl)cyclohexan-1-one, 2-Methyl-4-(1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl)cyclohexanone
| Molecular Formula | C17H28O |
|---|---|
| Molecular Weight | 248.21 g/mol |
| LogP | 4.4541 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 248.21402 |
| Heavy Atoms | 18 |
| Complexity | 369.8064 |
Chemical Identifiers
| CAS Number | 63779-21-5 |
|---|---|
| SMILES | CC1CC(CCC1=O)C2CC3CCC2(C3(C)C)C |
Product Overview
4-Isobornyl-2-methylcyclohexan-1-one (CAS 63779-21-5), with molecular formula C17H28O and molecular weight 248.21 g/mol. IUPAC: 2-methyl-4-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)cyclohexan-1-one.
Chemical Property Profile of 4-Isobornyl-2-methylcyclohexan-1-one
Property Insights of 4-Isobornyl-2-methylcyclohexan-1-one
The XLogP value of 4.4541 indicates that 4-Isobornyl-2-methylcyclohexan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 4-Isobornyl-2-methylcyclohexan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Isobornyl-2-methylcyclohexan-1-one 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 4-Isobornyl-2-methylcyclohexan-1-one?
The CAS number of 4-Isobornyl-2-methylcyclohexan-1-one is 63779-21-5.
What is the molecular formula of 4-Isobornyl-2-methylcyclohexan-1-one?
The molecular formula of 4-Isobornyl-2-methylcyclohexan-1-one is C17H28O.
What is the molecular weight of 4-Isobornyl-2-methylcyclohexan-1-one?
The molecular weight of 4-Isobornyl-2-methylcyclohexan-1-one is 248.21 g/mol.
Where can I buy 4-Isobornyl-2-methylcyclohexan-1-one?
You can request a quote for 4-Isobornyl-2-methylcyclohexan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Isobornyl-2-methylcyclohexan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Isobornyl-2-methylcyclohexan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.