(E)-5-methylhex-3-enoic acid
TL;DR: (E)-5-methylhex-3-enoic acid (CAS 62356-03-0) is a chemical compound with molecular formula C7H12O2 and molecular weight 128.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-5-methylhex-3-enoic acid
Also Known As: (E)-5-methylhex-3-enoic acid, 5-methylhex-3-enoic acid, 5-Methyl-3-hexenoic acid, 4-Hexenoic acid, 5-methyl-, (3E)-5-METHYLHEX-3-ENOIC ACID
| Molecular Formula | C7H12O2 |
|---|---|
| Molecular Weight | 128.08 g/mol |
| LogP | 1.6733 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 128.08372 |
| Heavy Atoms | 9 |
| Complexity | 114.08456 |
Chemical Identifiers
| CAS Number | 62356-03-0 |
|---|---|
| SMILES | CC(C)/C=C/CC(=O)O |
Product Overview
(E)-5-methylhex-3-enoic acid (CAS 62356-03-0), with molecular formula C7H12O2 and molecular weight 128.08 g/mol. IUPAC: (E)-5-methylhex-3-enoic acid.
Chemical Property Profile of (E)-5-methylhex-3-enoic acid
Property Insights of (E)-5-methylhex-3-enoic acid
The XLogP value of 1.6733 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-5-methylhex-3-enoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, (E)-5-methylhex-3-enoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-5-methylhex-3-enoic 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 (E)-5-methylhex-3-enoic acid?
The CAS number of (E)-5-methylhex-3-enoic acid is 62356-03-0.
What is the molecular formula of (E)-5-methylhex-3-enoic acid?
The molecular formula of (E)-5-methylhex-3-enoic acid is C7H12O2.
What is the molecular weight of (E)-5-methylhex-3-enoic acid?
The molecular weight of (E)-5-methylhex-3-enoic acid is 128.08 g/mol.
Where can I buy (E)-5-methylhex-3-enoic acid?
You can request a quote for (E)-5-methylhex-3-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-5-methylhex-3-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-5-methylhex-3-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.