3,7-Dimethyloctane-1,2,6-triol
TL;DR: 3,7-Dimethyloctane-1,2,6-triol (CAS 57197-01-0) is a chemical compound with molecular formula C10H22O3 and molecular weight 190.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-dimethyloctane-1,2,6-triol
Also Known As: 3,7-dimethyloctane-1,2,6-triol, 3,7-Dimethyl-1,2,6-octan-triol, J3.741.368B
| Molecular Formula | C10H22O3 |
|---|---|
| Molecular Weight | 190.16 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 190.15689 |
| Heavy Atoms | 13 |
| Complexity | 125.0 |
Chemical Identifiers
| CAS Number | 57197-01-0 |
|---|---|
| SMILES | CC(C)C(CCC(C)C(CO)O)O |
| InChIKey | WIVLLAPUXOZBMQ-UHFFFAOYSA-N |
Product Overview
3,7-Dimethyloctane-1,2,6-triol (CAS 57197-01-0), with molecular formula C10H22O3 and molecular weight 190.16 g/mol. IUPAC: 3,7-dimethyloctane-1,2,6-triol.
Chemical Property Profile of 3,7-Dimethyloctane-1,2,6-triol
Property Insights of 3,7-Dimethyloctane-1,2,6-triol
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,7-Dimethyloctane-1,2,6-triol. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,7-Dimethyloctane-1,2,6-triol. Following Lipinski's Rule of Five, 3,7-Dimethyloctane-1,2,6-triol has 3 hydrogen bond donor(s) and 3 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 3,7-Dimethyloctane-1,2,6-triol?
The CAS number of 3,7-Dimethyloctane-1,2,6-triol is 57197-01-0.
What is the molecular formula of 3,7-Dimethyloctane-1,2,6-triol?
The molecular formula of 3,7-Dimethyloctane-1,2,6-triol is C10H22O3.
What is the molecular weight of 3,7-Dimethyloctane-1,2,6-triol?
The molecular weight of 3,7-Dimethyloctane-1,2,6-triol is 190.16 g/mol.
Where can I buy 3,7-Dimethyloctane-1,2,6-triol?
You can request a quote for 3,7-Dimethyloctane-1,2,6-triol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7-Dimethyloctane-1,2,6-triol?
Yes, KEHONG BIO provides custom synthesis services for 3,7-Dimethyloctane-1,2,6-triol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.