2,5-Dimethylidenecyclohexane-1,4-diol
TL;DR: 2,5-Dimethylidenecyclohexane-1,4-diol (CAS 4982-21-2) is a chemical compound with molecular formula C8H12O2 and molecular weight 140.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dimethylidenecyclohexane-1,4-diol
Also Known As: 2,5-dimethylidenecyclohexane-1,4-diol, NCIOpen2_000481, 1,4-Cyclohexanediol, 2,5-bis(methylene)-, trans-2,5-dihydroxy-1,4-dimethylene cyclohexane
| Molecular Formula | C8H12O2 |
|---|---|
| Molecular Weight | 140.08 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 140.08372 |
| Heavy Atoms | 10 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 4982-21-2 |
|---|---|
| SMILES | C=C1CC(C(=C)CC1O)O |
| InChIKey | WLKSZYPZGAQRKF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Dimethylidenecyclohexane-1,4-diol (CAS 4982-21-2), with molecular formula C8H12O2 and molecular weight 140.08 g/mol. IUPAC: 2,5-dimethylidenecyclohexane-1,4-diol.
Chemical Property Profile of 2,5-Dimethylidenecyclohexane-1,4-diol
Property Insights of 2,5-Dimethylidenecyclohexane-1,4-diol
The XLogP value of -0.2 indicates that 2,5-Dimethylidenecyclohexane-1,4-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.5 Ų, 2,5-Dimethylidenecyclohexane-1,4-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dimethylidenecyclohexane-1,4-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 2,5-Dimethylidenecyclohexane-1,4-diol?
The CAS number of 2,5-Dimethylidenecyclohexane-1,4-diol is 4982-21-2.
What is the molecular formula of 2,5-Dimethylidenecyclohexane-1,4-diol?
The molecular formula of 2,5-Dimethylidenecyclohexane-1,4-diol is C8H12O2.
What is the molecular weight of 2,5-Dimethylidenecyclohexane-1,4-diol?
The molecular weight of 2,5-Dimethylidenecyclohexane-1,4-diol is 140.08 g/mol.
Where can I buy 2,5-Dimethylidenecyclohexane-1,4-diol?
You can request a quote for 2,5-Dimethylidenecyclohexane-1,4-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dimethylidenecyclohexane-1,4-diol?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dimethylidenecyclohexane-1,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.