4-oxo-2E-Octenal
TL;DR: 4-oxo-2E-Octenal (CAS 2497-14-5) 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.
(E)-4-oxooct-2-enal
Also Known As: 4-oxo-2E-Octenal, 4-oxo-2-octenal, (E)-4-oxooct-2-enal, 4-oxooct-2-enal, (e)-4-oxo-2-octenal
| Molecular Formula | C8H12O2 |
|---|---|
| Molecular Weight | 140.08 g/mol |
| LogP | 1.5008 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 140.08372 |
| Heavy Atoms | 10 |
| Complexity | 136.19302 |
Chemical Identifiers
| CAS Number | 2497-14-5 |
|---|---|
| SMILES | CCCCC(=O)/C=C/C=O |
Product Overview
4-oxo-2E-Octenal (CAS 2497-14-5), with molecular formula C8H12O2 and molecular weight 140.08 g/mol. IUPAC: (E)-4-oxooct-2-enal.
Chemical Property Profile of 4-oxo-2E-Octenal
Property Insights of 4-oxo-2E-Octenal
The XLogP value of 1.5008 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-oxo-2E-Octenal. With a topological polar surface area (TPSA) of 34.14 Ų, 4-oxo-2E-Octenal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-oxo-2E-Octenal has 0 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 4-oxo-2E-Octenal?
The CAS number of 4-oxo-2E-Octenal is 2497-14-5.
What is the molecular formula of 4-oxo-2E-Octenal?
The molecular formula of 4-oxo-2E-Octenal is C8H12O2.
What is the molecular weight of 4-oxo-2E-Octenal?
The molecular weight of 4-oxo-2E-Octenal is 140.08 g/mol.
Where can I buy 4-oxo-2E-Octenal?
You can request a quote for 4-oxo-2E-Octenal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-oxo-2E-Octenal?
Yes, KEHONG BIO provides custom synthesis services for 4-oxo-2E-Octenal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.