1-Methyl-1,2-cyclopentanediol
TL;DR: 1-Methyl-1,2-cyclopentanediol (CAS 5447-67-6) is a chemical compound with molecular formula C6H12O2 and molecular weight 116.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylcyclopentane-1,2-diol
Also Known As: 1-methylcyclopentane-1,2-diol, 1,2-Cyclopentanediol, 1-methyl-, trans-, 1, 1-methyl-, trans-, CC1(O)CCCC1O, 1-methyl-1,2-cyclopentanediol
| Molecular Formula | C6H12O2 |
|---|---|
| Molecular Weight | 116.08 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 116.08373 |
| Heavy Atoms | 8 |
| Complexity | 92.0 |
Chemical Identifiers
| CAS Number | 5447-67-6 |
|---|---|
| SMILES | CC1(CCCC1O)O |
| InChIKey | CVZBNRSGTBIHPO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-1,2-cyclopentanediol (CAS 5447-67-6), with molecular formula C6H12O2 and molecular weight 116.08 g/mol. IUPAC: 1-methylcyclopentane-1,2-diol.
Chemical Property Profile of 1-Methyl-1,2-cyclopentanediol
Property Insights of 1-Methyl-1,2-cyclopentanediol
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-1,2-cyclopentanediol. With a topological polar surface area (TPSA) of 40.5 Ų, 1-Methyl-1,2-cyclopentanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-1,2-cyclopentanediol 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 1-Methyl-1,2-cyclopentanediol?
The CAS number of 1-Methyl-1,2-cyclopentanediol is 5447-67-6.
What is the molecular formula of 1-Methyl-1,2-cyclopentanediol?
The molecular formula of 1-Methyl-1,2-cyclopentanediol is C6H12O2.
What is the molecular weight of 1-Methyl-1,2-cyclopentanediol?
The molecular weight of 1-Methyl-1,2-cyclopentanediol is 116.08 g/mol.
Where can I buy 1-Methyl-1,2-cyclopentanediol?
You can request a quote for 1-Methyl-1,2-cyclopentanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-1,2-cyclopentanediol?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-1,2-cyclopentanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.