2,4-Dimethylhept-2-enal
TL;DR: 2,4-Dimethylhept-2-enal (CAS 85136-08-9) is a chemical compound with molecular formula C9H16O and molecular weight 140.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dimethylhept-2-enal
Also Known As: 2,4-dimethylhept-2-enal, 2,4-dimethyl-2-heptenal, 2,4-Dimethylhepta-2,2-dienal, 2,4-dimethyl hepta-2-dienal, 2,6-Heptadienal, 2,4-dimethyl-
| Molecular Formula | C9H16O |
|---|---|
| Molecular Weight | 140.12 g/mol |
| LogP | 2.5678 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 140.12012 |
| Heavy Atoms | 10 |
| Complexity | 124.68996 |
Chemical Identifiers
| CAS Number | 85136-08-9 |
|---|---|
| SMILES | CCCC(C)C=C(C)C=O |
Product Overview
2,4-Dimethylhept-2-enal (CAS 85136-08-9), with molecular formula C9H16O and molecular weight 140.12 g/mol. IUPAC: 2,4-dimethylhept-2-enal.
Chemical Property Profile of 2,4-Dimethylhept-2-enal
Property Insights of 2,4-Dimethylhept-2-enal
The XLogP value of 2.5678 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Dimethylhept-2-enal. With a topological polar surface area (TPSA) of 17.07 Ų, 2,4-Dimethylhept-2-enal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dimethylhept-2-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 2,4-Dimethylhept-2-enal?
The CAS number of 2,4-Dimethylhept-2-enal is 85136-08-9.
What is the molecular formula of 2,4-Dimethylhept-2-enal?
The molecular formula of 2,4-Dimethylhept-2-enal is C9H16O.
What is the molecular weight of 2,4-Dimethylhept-2-enal?
The molecular weight of 2,4-Dimethylhept-2-enal is 140.12 g/mol.
Where can I buy 2,4-Dimethylhept-2-enal?
You can request a quote for 2,4-Dimethylhept-2-enal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dimethylhept-2-enal?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dimethylhept-2-enal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.