4-Methylcyclohexane-1,2-diol
TL;DR: 4-Methylcyclohexane-1,2-diol (CAS 23942-29-2) is a chemical compound with molecular formula C7H14O2 and molecular weight 130.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylcyclohexane-1,2-diol
Also Known As: 4-methylcyclohexane-1,2-diol, 4-methyl-1,2-cyclohexanediol, NCIOpen2_000334, 1-METHYL-2-DECALONE MIXTURE OF ISOMERS, RefChem:1071158
| Molecular Formula | C7H14O2 |
|---|---|
| Molecular Weight | 130.10 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 130.09938 |
| Heavy Atoms | 9 |
| Complexity | 92.0 |
Chemical Identifiers
| CAS Number | 23942-29-2 |
|---|---|
| SMILES | CC1CCC(C(C1)O)O |
| InChIKey | GAASGTOOMWIDNB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methylcyclohexane-1,2-diol (CAS 23942-29-2), with molecular formula C7H14O2 and molecular weight 130.10 g/mol. IUPAC: 4-methylcyclohexane-1,2-diol.
Chemical Property Profile of 4-Methylcyclohexane-1,2-diol
Property Insights of 4-Methylcyclohexane-1,2-diol
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methylcyclohexane-1,2-diol. With a topological polar surface area (TPSA) of 40.5 Ų, 4-Methylcyclohexane-1,2-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methylcyclohexane-1,2-diol has 2 hydrogen bond donor(s) and 2 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-Methylcyclohexane-1,2-diol?
The CAS number of 4-Methylcyclohexane-1,2-diol is 23942-29-2.
What is the molecular formula of 4-Methylcyclohexane-1,2-diol?
The molecular formula of 4-Methylcyclohexane-1,2-diol is C7H14O2.
What is the molecular weight of 4-Methylcyclohexane-1,2-diol?
The molecular weight of 4-Methylcyclohexane-1,2-diol is 130.10 g/mol.
Where can I buy 4-Methylcyclohexane-1,2-diol?
You can request a quote for 4-Methylcyclohexane-1,2-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylcyclohexane-1,2-diol?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylcyclohexane-1,2-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.