4,7-Dimethyldecane-4,7-diol
TL;DR: 4,7-Dimethyldecane-4,7-diol (CAS 72016-54-7) is a chemical compound with molecular formula C12H26O2 and molecular weight 202.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,7-dimethyldecane-4,7-diol
Also Known As: 4,7-dimethyldecane-4,7-diol, 4,7-Decanediol,4,7-dimethyl, 4,7-Decanediol,4,7-dimethyl-
| Molecular Formula | C12H26O2 |
|---|---|
| Molecular Weight | 202.19 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 202.19328 |
| Heavy Atoms | 14 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 72016-54-7 |
|---|---|
| SMILES | CCCC(C)(CCC(C)(CCC)O)O |
| InChIKey | VGRYQTVSPZCCQK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4,7-Dimethyldecane-4,7-diol (CAS 72016-54-7), with molecular formula C12H26O2 and molecular weight 202.19 g/mol. IUPAC: 4,7-dimethyldecane-4,7-diol.
Chemical Property Profile of 4,7-Dimethyldecane-4,7-diol
Property Insights of 4,7-Dimethyldecane-4,7-diol
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,7-Dimethyldecane-4,7-diol. With a topological polar surface area (TPSA) of 40.5 Ų, 4,7-Dimethyldecane-4,7-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,7-Dimethyldecane-4,7-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 4,7-Dimethyldecane-4,7-diol?
The CAS number of 4,7-Dimethyldecane-4,7-diol is 72016-54-7.
What is the molecular formula of 4,7-Dimethyldecane-4,7-diol?
The molecular formula of 4,7-Dimethyldecane-4,7-diol is C12H26O2.
What is the molecular weight of 4,7-Dimethyldecane-4,7-diol?
The molecular weight of 4,7-Dimethyldecane-4,7-diol is 202.19 g/mol.
Where can I buy 4,7-Dimethyldecane-4,7-diol?
You can request a quote for 4,7-Dimethyldecane-4,7-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,7-Dimethyldecane-4,7-diol?
Yes, KEHONG BIO provides custom synthesis services for 4,7-Dimethyldecane-4,7-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.