1,6-Octanediol, 3,7-dimethyl-
TL;DR: 1,6-Octanediol, 3,7-dimethyl- (CAS 53067-10-0) is a chemical compound with molecular formula C10H22O2 and molecular weight 174.16199 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,7-dimethyloctane-1,6-diol
Also Known As: 3,7-Dimethyloctane-1,6-diol, 3,7-Dimethyl-1,6-octanediol, 1,6-Octanediol, 3,7-dimethyl-, 3,7-Dimethyl-octane-1,6-diol, EINECS 258-341-8
Technical Specifications
| Molecular Formula | C10H22O2 |
| Molecular Weight | 174.16199 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 174.16199 Da |
| Heavy Atoms | 12 |
| Complexity | 102.0 |
| SMILES | CC(C)C(CCC(C)CCO)O |
| InChIKey | NNEAXJVXQGZFAF-UHFFFAOYSA-N |
Chemical Property Profile of 1,6-Octanediol, 3,7-dimethyl-
Property Insights of 1,6-Octanediol, 3,7-dimethyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,6-Octanediol, 3,7-dimethyl-. With a topological polar surface area (TPSA) of 40.5 Ų, 1,6-Octanediol, 3,7-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,6-Octanediol, 3,7-dimethyl- 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
What is the CAS number of 1,6-Octanediol, 3,7-dimethyl-?
The CAS number of 1,6-Octanediol, 3,7-dimethyl- is 53067-10-0.
What is the molecular formula of 1,6-Octanediol, 3,7-dimethyl-?
The molecular formula of 1,6-Octanediol, 3,7-dimethyl- is C10H22O2.
What is the molecular weight of 1,6-Octanediol, 3,7-dimethyl-?
The molecular weight of 1,6-Octanediol, 3,7-dimethyl- is 174.16199 g/mol.
Where can I buy 1,6-Octanediol, 3,7-dimethyl-?
You can request a quote for 1,6-Octanediol, 3,7-dimethyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,6-Octanediol, 3,7-dimethyl-?
Yes, CoreyChem provides custom synthesis services for 1,6-Octanediol, 3,7-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.