(3,4-Dimethylcyclohex-3-en-1-yl)methanol
TL;DR: (3,4-Dimethylcyclohex-3-en-1-yl)methanol (CAS 93800-77-2) is a chemical compound with molecular formula C9H16O and molecular weight 140.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dimethylcyclohex-3-en-1-yl)methanol
Also Known As: 3,4-Dimethyl-3-cyclohexenylmethanal, (3,4-dimethylcyclohex-3-en-1-yl)methanol, 3-Cyclohexene-1-methanol, 3,4-dimethyl-, 3-Cyclohexene-1-methanol, 3,4-dimethyl-, (R)-
| Molecular Formula | C9H16O |
|---|---|
| Molecular Weight | 140.12 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 140.12012 |
| Heavy Atoms | 10 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 93800-77-2 |
|---|---|
| SMILES | CC1=C(CC(CC1)CO)C |
| InChIKey | STYNQPWPNFPCLE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3,4-Dimethylcyclohex-3-en-1-yl)methanol (CAS 93800-77-2), with molecular formula C9H16O and molecular weight 140.12 g/mol. IUPAC: (3,4-dimethylcyclohex-3-en-1-yl)methanol.
Chemical Property Profile of (3,4-Dimethylcyclohex-3-en-1-yl)methanol
Property Insights of (3,4-Dimethylcyclohex-3-en-1-yl)methanol
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,4-Dimethylcyclohex-3-en-1-yl)methanol. With a topological polar surface area (TPSA) of 20.2 Ų, (3,4-Dimethylcyclohex-3-en-1-yl)methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,4-Dimethylcyclohex-3-en-1-yl)methanol has 1 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 (3,4-Dimethylcyclohex-3-en-1-yl)methanol?
The CAS number of (3,4-Dimethylcyclohex-3-en-1-yl)methanol is 93800-77-2.
What is the molecular formula of (3,4-Dimethylcyclohex-3-en-1-yl)methanol?
The molecular formula of (3,4-Dimethylcyclohex-3-en-1-yl)methanol is C9H16O.
What is the molecular weight of (3,4-Dimethylcyclohex-3-en-1-yl)methanol?
The molecular weight of (3,4-Dimethylcyclohex-3-en-1-yl)methanol is 140.12 g/mol.
Where can I buy (3,4-Dimethylcyclohex-3-en-1-yl)methanol?
You can request a quote for (3,4-Dimethylcyclohex-3-en-1-yl)methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,4-Dimethylcyclohex-3-en-1-yl)methanol?
Yes, KEHONG BIO provides custom synthesis services for (3,4-Dimethylcyclohex-3-en-1-yl)methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.