2,5-Dimethyl-2-vinyl-4-hexenal
TL;DR: 2,5-Dimethyl-2-vinyl-4-hexenal (CAS 56134-05-5) is a chemical compound with molecular formula C10H16O and molecular weight 152.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethenyl-2,5-dimethylhex-4-enal
Also Known As: Neroli aldehyde, 2,5-Dimethyl-2-vinylhex-4-enal, 2,5-Dimethyl-2-vinyl-4-hexenal, 2-ethenyl-2,5-dimethylhex-4-enal, 4-Hexenal, 2-ethenyl-2,5-dimethyl-
| Molecular Formula | C10H16O |
|---|---|
| Molecular Weight | 152.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 152.12012 |
| Heavy Atoms | 11 |
| Complexity | 175.0 |
Chemical Identifiers
| CAS Number | 56134-05-5 |
|---|---|
| SMILES | CC(=CCC(C)(C=C)C=O)C |
| InChIKey | FGBSITKWTRVADL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Dimethyl-2-vinyl-4-hexenal (CAS 56134-05-5), with molecular formula C10H16O and molecular weight 152.12 g/mol. IUPAC: 2-ethenyl-2,5-dimethylhex-4-enal.
Chemical Property Profile of 2,5-Dimethyl-2-vinyl-4-hexenal
Property Insights of 2,5-Dimethyl-2-vinyl-4-hexenal
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Dimethyl-2-vinyl-4-hexenal. With a topological polar surface area (TPSA) of 17.1 Ų, 2,5-Dimethyl-2-vinyl-4-hexenal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dimethyl-2-vinyl-4-hexenal 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 2,5-Dimethyl-2-vinyl-4-hexenal?
The CAS number of 2,5-Dimethyl-2-vinyl-4-hexenal is 56134-05-5.
What is the molecular formula of 2,5-Dimethyl-2-vinyl-4-hexenal?
The molecular formula of 2,5-Dimethyl-2-vinyl-4-hexenal is C10H16O.
What is the molecular weight of 2,5-Dimethyl-2-vinyl-4-hexenal?
The molecular weight of 2,5-Dimethyl-2-vinyl-4-hexenal is 152.12 g/mol.
Where can I buy 2,5-Dimethyl-2-vinyl-4-hexenal?
You can request a quote for 2,5-Dimethyl-2-vinyl-4-hexenal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dimethyl-2-vinyl-4-hexenal?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dimethyl-2-vinyl-4-hexenal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.