2-Methylideneoct-5-enal
TL;DR: 2-Methylideneoct-5-enal (CAS 94088-13-8) is a chemical compound with molecular formula C9H14O and molecular weight 138.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylideneoct-5-enal
Also Known As: (Z)-2-Methyleneoct-5-enal
| Molecular Formula | C9H14O |
|---|---|
| Molecular Weight | 138.10 g/mol |
| LogP | 2.4879 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 138.10446 |
| Heavy Atoms | 10 |
| Complexity | 133.6637 |
Chemical Identifiers
| CAS Number | 94088-13-8 |
|---|---|
| SMILES | CCC=CCCC(=C)C=O |
Product Overview
2-Methylideneoct-5-enal (CAS 94088-13-8), with molecular formula C9H14O and molecular weight 138.10 g/mol. IUPAC: 2-methylideneoct-5-enal.
Chemical Property Profile of 2-Methylideneoct-5-enal
Property Insights of 2-Methylideneoct-5-enal
The XLogP value of 2.4879 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methylideneoct-5-enal. With a topological polar surface area (TPSA) of 17.07 Ų, 2-Methylideneoct-5-enal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methylideneoct-5-enal has 0 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 2-Methylideneoct-5-enal?
The CAS number of 2-Methylideneoct-5-enal is 94088-13-8.
What is the molecular formula of 2-Methylideneoct-5-enal?
The molecular formula of 2-Methylideneoct-5-enal is C9H14O.
What is the molecular weight of 2-Methylideneoct-5-enal?
The molecular weight of 2-Methylideneoct-5-enal is 138.10 g/mol.
Where can I buy 2-Methylideneoct-5-enal?
You can request a quote for 2-Methylideneoct-5-enal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methylideneoct-5-enal?
Yes, KEHONG BIO provides custom synthesis services for 2-Methylideneoct-5-enal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.