3,7-Dimethyl-3,6-octadienoic acid
TL;DR: 3,7-Dimethyl-3,6-octadienoic acid (CAS 85391-92-0) is a chemical compound with molecular formula C10H16O2 and molecular weight 168.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,7-dimethylocta-3,6-dienoic acid
Also Known As: 3,7-Dimethyl-3,6-octadienoic acid, 3,7-Dimethylocta-3,6-dienoic acid, 3,6-Octadienoic acid,3,7-dimethyl-
| Molecular Formula | C10H16O2 |
|---|---|
| Molecular Weight | 168.12 g/mol |
| LogP | 2.7637 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.11504 |
| Heavy Atoms | 12 |
| Complexity | 207.87846 |
Chemical Identifiers
| CAS Number | 85391-92-0 |
|---|---|
| SMILES | CC(=CCC=C(C)CC(=O)O)C |
Product Overview
3,7-Dimethyl-3,6-octadienoic acid (CAS 85391-92-0), with molecular formula C10H16O2 and molecular weight 168.12 g/mol. IUPAC: 3,7-dimethylocta-3,6-dienoic acid.
Chemical Property Profile of 3,7-Dimethyl-3,6-octadienoic acid
Property Insights of 3,7-Dimethyl-3,6-octadienoic acid
The XLogP value of 2.7637 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,7-Dimethyl-3,6-octadienoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 3,7-Dimethyl-3,6-octadienoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,7-Dimethyl-3,6-octadienoic acid has 1 hydrogen bond donor(s) and 1 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-Dimethyl-3,6-octadienoic acid?
The CAS number of 3,7-Dimethyl-3,6-octadienoic acid is 85391-92-0.
What is the molecular formula of 3,7-Dimethyl-3,6-octadienoic acid?
The molecular formula of 3,7-Dimethyl-3,6-octadienoic acid is C10H16O2.
What is the molecular weight of 3,7-Dimethyl-3,6-octadienoic acid?
The molecular weight of 3,7-Dimethyl-3,6-octadienoic acid is 168.12 g/mol.
Where can I buy 3,7-Dimethyl-3,6-octadienoic acid?
You can request a quote for 3,7-Dimethyl-3,6-octadienoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7-Dimethyl-3,6-octadienoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3,7-Dimethyl-3,6-octadienoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.