4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol
TL;DR: 4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol (CAS 20053-40-1) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-hydroxypropan-2-yl)-1-methylcyclohex-2-en-1-ol
Also Known As: ChemDiv1_018896, cis-2-Menthen-1,8-diol, p-mentha-2-ene-1,8-diol, (1R,4R)-2-Menthene-1,8-diol, DivK1c_003680
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 20053-40-1 |
|---|---|
| SMILES | CC1(CCC(C=C1)C(C)(C)O)O |
| InChIKey | XWFVRMWMBYDDFY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol (CAS 20053-40-1), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: 4-(2-hydroxypropan-2-yl)-1-methylcyclohex-2-en-1-ol.
Chemical Property Profile of 4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol
Property Insights of 4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol. With a topological polar surface area (TPSA) of 40.5 Ų, 4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol 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-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol?
The CAS number of 4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol is 20053-40-1.
What is the molecular formula of 4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol?
The molecular formula of 4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol is C10H18O2.
What is the molecular weight of 4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol?
The molecular weight of 4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol is 170.13 g/mol.
Where can I buy 4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol?
You can request a quote for 4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol?
Yes, KEHONG BIO provides custom synthesis services for 4-Hydroxy-alpha,alpha,4-trimethylcyclohex-2-ene-1-methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.