3,7-Dimethyloct-2-enal
TL;DR: 3,7-Dimethyloct-2-enal (CAS 57784-35-7) is a chemical compound with molecular formula C10H18O and molecular weight 154.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3,7-dimethyloct-2-enal
Also Known As: 6,7-dihydrogeranial, 3,7-Dimethyloct-2-enal, 3,7-dimethyl-2-octenal, (E)-3,7-dimethyloct-2-enal, 2-Octenal, 3,7-dimethyl-
| Molecular Formula | C10H18O |
|---|---|
| Molecular Weight | 154.14 g/mol |
| LogP | 2.9579 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 154.13577 |
| Heavy Atoms | 11 |
| Complexity | 133.8082 |
Chemical Identifiers
| CAS Number | 57784-35-7 |
|---|---|
| SMILES | CC(C)CCC/C(=C/C=O)/C |
Product Overview
3,7-Dimethyloct-2-enal (CAS 57784-35-7), with molecular formula C10H18O and molecular weight 154.14 g/mol. IUPAC: (E)-3,7-dimethyloct-2-enal.
Chemical Property Profile of 3,7-Dimethyloct-2-enal
Property Insights of 3,7-Dimethyloct-2-enal
The XLogP value of 2.9579 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,7-Dimethyloct-2-enal. With a topological polar surface area (TPSA) of 17.07 Ų, 3,7-Dimethyloct-2-enal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,7-Dimethyloct-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 3,7-Dimethyloct-2-enal?
The CAS number of 3,7-Dimethyloct-2-enal is 57784-35-7.
What is the molecular formula of 3,7-Dimethyloct-2-enal?
The molecular formula of 3,7-Dimethyloct-2-enal is C10H18O.
What is the molecular weight of 3,7-Dimethyloct-2-enal?
The molecular weight of 3,7-Dimethyloct-2-enal is 154.14 g/mol.
Where can I buy 3,7-Dimethyloct-2-enal?
You can request a quote for 3,7-Dimethyloct-2-enal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,7-Dimethyloct-2-enal?
Yes, KEHONG BIO provides custom synthesis services for 3,7-Dimethyloct-2-enal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.