(3E)-3,5-Hexadienoic acid
TL;DR: (3E)-3,5-Hexadienoic acid (CAS 29949-29-9) is a chemical compound with molecular formula C6H8O2 and molecular weight 112.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3E)-hexa-3,5-dienoic acid
Also Known As: 3,5-hexadienoic acid, (3E)-hexa-3,5-dienoic acid, (3E)-3,5-Hexadienoic acid, trans-hexa-3,5-dienoic acid, HEXA-3,5-DIENOIC ACID
| Molecular Formula | C6H8O2 |
|---|---|
| Molecular Weight | 112.05 g/mol |
| LogP | 1.2033 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 112.05243 |
| Heavy Atoms | 8 |
| Complexity | 113.696945 |
Chemical Identifiers
| CAS Number | 29949-29-9 |
|---|---|
| SMILES | C=C/C=C/CC(=O)O |
Product Overview
(3E)-3,5-Hexadienoic acid (CAS 29949-29-9), with molecular formula C6H8O2 and molecular weight 112.05 g/mol. IUPAC: (3E)-hexa-3,5-dienoic acid.
Chemical Property Profile of (3E)-3,5-Hexadienoic acid
Property Insights of (3E)-3,5-Hexadienoic acid
The XLogP value of 1.2033 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3E)-3,5-Hexadienoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, (3E)-3,5-Hexadienoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3E)-3,5-Hexadienoic 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 (3E)-3,5-Hexadienoic acid?
The CAS number of (3E)-3,5-Hexadienoic acid is 29949-29-9.
What is the molecular formula of (3E)-3,5-Hexadienoic acid?
The molecular formula of (3E)-3,5-Hexadienoic acid is C6H8O2.
What is the molecular weight of (3E)-3,5-Hexadienoic acid?
The molecular weight of (3E)-3,5-Hexadienoic acid is 112.05 g/mol.
Where can I buy (3E)-3,5-Hexadienoic acid?
You can request a quote for (3E)-3,5-Hexadienoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3E)-3,5-Hexadienoic acid?
Yes, KEHONG BIO provides custom synthesis services for (3E)-3,5-Hexadienoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.