2-Isopropenyl-5-methylhex-4-enal
TL;DR: 2-Isopropenyl-5-methylhex-4-enal (CAS 75697-98-2) 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.
5-methyl-2-prop-1-en-2-ylhex-4-enal
Also Known As: 2-Isopropenyl-5-methylhex-4-enal, 2-Isopropenyl-5-methyl-4-hexenal, 5-Methyl-2-isopropenyl-4-hexenal, 5-methyl-2-prop-1-en-2-ylhex-4-enal, 2-Isopropenyl-5-methyl-4-hexenal #
| Molecular Formula | C10H16O |
|---|---|
| Molecular Weight | 152.12 g/mol |
| LogP | 3.1 |
| 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 | 173.0 |
Chemical Identifiers
| CAS Number | 75697-98-2 |
|---|---|
| SMILES | CC(=CCC(C=O)C(=C)C)C |
| InChIKey | PAIVGFRXYIGODL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Isopropenyl-5-methylhex-4-enal (CAS 75697-98-2), with molecular formula C10H16O and molecular weight 152.12 g/mol. IUPAC: 5-methyl-2-prop-1-en-2-ylhex-4-enal.
Chemical Property Profile of 2-Isopropenyl-5-methylhex-4-enal
Property Insights of 2-Isopropenyl-5-methylhex-4-enal
The XLogP value of 3.1 indicates that 2-Isopropenyl-5-methylhex-4-enal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Isopropenyl-5-methylhex-4-enal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Isopropenyl-5-methylhex-4-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-Isopropenyl-5-methylhex-4-enal?
The CAS number of 2-Isopropenyl-5-methylhex-4-enal is 75697-98-2.
What is the molecular formula of 2-Isopropenyl-5-methylhex-4-enal?
The molecular formula of 2-Isopropenyl-5-methylhex-4-enal is C10H16O.
What is the molecular weight of 2-Isopropenyl-5-methylhex-4-enal?
The molecular weight of 2-Isopropenyl-5-methylhex-4-enal is 152.12 g/mol.
Where can I buy 2-Isopropenyl-5-methylhex-4-enal?
You can request a quote for 2-Isopropenyl-5-methylhex-4-enal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Isopropenyl-5-methylhex-4-enal?
Yes, KEHONG BIO provides custom synthesis services for 2-Isopropenyl-5-methylhex-4-enal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.