4-Hexenal, 5-methyl-2-(1-methylethyl)-
TL;DR: 4-Hexenal, 5-methyl-2-(1-methylethyl)- (CAS 58191-81-4) 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.
5-methyl-2-propan-2-ylhex-4-enal
Also Known As: 2-Isopropyl-5-methylhex-4-enal, 4-Hexenal, 5-methyl-2-(1-methylethyl)-, 2-isopropyl-5-methyl-4-hexenal, 5-methyl-2-propan-2-ylhex-4-enal, 2-Isopropyl-5-methyl-hex-4-enal
| Molecular Formula | C10H18O |
|---|---|
| Molecular Weight | 154.14 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 154.13577 |
| Heavy Atoms | 11 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 58191-81-4 |
|---|---|
| SMILES | CC(C)C(CC=C(C)C)C=O |
| InChIKey | QGWHBDAFRDCSBJ-UHFFFAOYSA-N |
Product Overview
4-Hexenal, 5-methyl-2-(1-methylethyl)- (CAS 58191-81-4), with molecular formula C10H18O and molecular weight 154.14 g/mol. IUPAC: 5-methyl-2-propan-2-ylhex-4-enal.
Chemical Property Profile of 4-Hexenal, 5-methyl-2-(1-methylethyl)-
Property Insights of 4-Hexenal, 5-methyl-2-(1-methylethyl)-
The XLogP value of 3.0 indicates that 4-Hexenal, 5-methyl-2-(1-methylethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 4-Hexenal, 5-methyl-2-(1-methylethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hexenal, 5-methyl-2-(1-methylethyl)- 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 4-Hexenal, 5-methyl-2-(1-methylethyl)-?
The CAS number of 4-Hexenal, 5-methyl-2-(1-methylethyl)- is 58191-81-4.
What is the molecular formula of 4-Hexenal, 5-methyl-2-(1-methylethyl)-?
The molecular formula of 4-Hexenal, 5-methyl-2-(1-methylethyl)- is C10H18O.
What is the molecular weight of 4-Hexenal, 5-methyl-2-(1-methylethyl)-?
The molecular weight of 4-Hexenal, 5-methyl-2-(1-methylethyl)- is 154.14 g/mol.
Where can I buy 4-Hexenal, 5-methyl-2-(1-methylethyl)-?
You can request a quote for 4-Hexenal, 5-methyl-2-(1-methylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hexenal, 5-methyl-2-(1-methylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 4-Hexenal, 5-methyl-2-(1-methylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.