1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate
TL;DR: 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate (CAS 94201-35-1) is a chemical compound with molecular formula C14H24O2 and molecular weight 224.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,8-trimethylnona-1,7-dien-4-yl acetate
Also Known As: 1,5-dimethyl-1- hex-4-enylacetate, 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate, 2,4,8-trimethylnona-1,7-dien-4-yl acetate, 2,4,8-Trimethyl-1,7-nonadien-4-ol acetate, 1,7-Nonadien-4-ol,?2,4,8-trimethyl-, acetate
| Molecular Formula | C14H24O2 |
|---|---|
| Molecular Weight | 224.18 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 224.17763 |
| Heavy Atoms | 16 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 94201-35-1 |
|---|---|
| SMILES | CC(=CCCC(C)(CC(=C)C)OC(=O)C)C |
| InChIKey | TZZHLXPJOWLPFA-UHFFFAOYSA-N |
Product Overview
1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate (CAS 94201-35-1), with molecular formula C14H24O2 and molecular weight 224.18 g/mol. IUPAC: 2,4,8-trimethylnona-1,7-dien-4-yl acetate.
Chemical Property Profile of 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate
Property Insights of 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate
The XLogP value of 4.4 indicates that 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate has 0 hydrogen bond donor(s) and 2 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 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate?
The CAS number of 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate is 94201-35-1.
What is the molecular formula of 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate?
The molecular formula of 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate is C14H24O2.
What is the molecular weight of 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate?
The molecular weight of 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate is 224.18 g/mol.
Where can I buy 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate?
You can request a quote for 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Dimethyl-1-(2-methylallyl)hex-4-enyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.