6-Methylhepta-2,6-dienoic acid
TL;DR: 6-Methylhepta-2,6-dienoic acid (CAS 7506-90-3) 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.
6-methylhepta-2,6-dienoic acid
Also Known As: NCIOpen2_003659, 6-methylhepta-2,6-dienoic acid, (2Z)-6-methylhepta-2,6-dienoic acid
| Molecular Formula | C8H12O2 |
|---|---|
| Molecular Weight | 140.08 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 140.08372 |
| Heavy Atoms | 10 |
| Complexity | 157.0 |
Chemical Identifiers
| CAS Number | 7506-90-3 |
|---|---|
| SMILES | CC(=C)CCC=CC(=O)O |
| InChIKey | POSCMQQIZVFKQI-UHFFFAOYSA-N |
Product Overview
6-Methylhepta-2,6-dienoic acid (CAS 7506-90-3), with molecular formula C8H12O2 and molecular weight 140.08 g/mol. IUPAC: 6-methylhepta-2,6-dienoic acid.
Chemical Property Profile of 6-Methylhepta-2,6-dienoic acid
Property Insights of 6-Methylhepta-2,6-dienoic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methylhepta-2,6-dienoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 6-Methylhepta-2,6-dienoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methylhepta-2,6-dienoic acid has 1 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 6-Methylhepta-2,6-dienoic acid?
The CAS number of 6-Methylhepta-2,6-dienoic acid is 7506-90-3.
What is the molecular formula of 6-Methylhepta-2,6-dienoic acid?
The molecular formula of 6-Methylhepta-2,6-dienoic acid is C8H12O2.
What is the molecular weight of 6-Methylhepta-2,6-dienoic acid?
The molecular weight of 6-Methylhepta-2,6-dienoic acid is 140.08 g/mol.
Where can I buy 6-Methylhepta-2,6-dienoic acid?
You can request a quote for 6-Methylhepta-2,6-dienoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Methylhepta-2,6-dienoic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-Methylhepta-2,6-dienoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.