trans-3-Hexenoic acid
TL;DR: trans-3-Hexenoic acid (CAS 1775-43-5) is a chemical compound with molecular formula C6H10O2 and molecular weight 114.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-hex-3-enoic acid
Also Known As: trans-3-Hexenoic acid, Hydrosorbic acid, 3-HEXENOIC ACID, (E)-hex-3-enoic acid, hex-3-enoic acid
| Molecular Formula | C6H10O2 |
|---|---|
| Molecular Weight | 114.07 g/mol |
| LogP | 1.4273 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 114.06808 |
| Heavy Atoms | 8 |
| Complexity | 94.70166 |
Chemical Identifiers
| CAS Number | 1775-43-5 |
|---|---|
| SMILES | CC/C=C/CC(=O)O |
Product Overview
trans-3-Hexenoic acid (CAS 1775-43-5), with molecular formula C6H10O2 and molecular weight 114.07 g/mol. IUPAC: (E)-hex-3-enoic acid.
Chemical Property Profile of trans-3-Hexenoic acid
Property Insights of trans-3-Hexenoic acid
The XLogP value of 1.4273 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trans-3-Hexenoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, trans-3-Hexenoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-3-Hexenoic 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 trans-3-Hexenoic acid?
The CAS number of trans-3-Hexenoic acid is 1775-43-5.
What is the molecular formula of trans-3-Hexenoic acid?
The molecular formula of trans-3-Hexenoic acid is C6H10O2.
What is the molecular weight of trans-3-Hexenoic acid?
The molecular weight of trans-3-Hexenoic acid is 114.07 g/mol.
Where can I buy trans-3-Hexenoic acid?
You can request a quote for trans-3-Hexenoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-3-Hexenoic acid?
Yes, KEHONG BIO provides custom synthesis services for trans-3-Hexenoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.