1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯
TL;DR: 1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯 (CAS 14481-55-1) is a chemical compound with molecular formula C15H26O2 and molecular weight 238.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯
2-(4-methylcyclohex-3-en-1-yl)propan-2-yl pentanoate
Also Known As: Terpinyl valerate, Terpenyl pentanoate, alpha-Terpinyl pentanoate, 1-Methyl-1-(4-methylcyclohex-3-enyl)ethyl valerate, Valeric acid, p-menth-1-en-8-yl ester
| Molecular Formula | C15H26O2 |
|---|---|
| Molecular Weight | 238.19 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 238.19328 |
| Heavy Atoms | 17 |
| Complexity | 289.0 |
| Boiling Point | 295.00 to 296.00 °C. @ 760.00 mm Hg |
Chemical Identifiers
| CAS Number | 14481-55-1 |
|---|---|
| SMILES | CCCCC(=O)OC(C)(C)C1CCC(=CC1)C |
| InChIKey | GIHNOWFSKYCHNL-UHFFFAOYSA-N |
Product Overview
1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯 (CAS 14481-55-1), with molecular formula C15H26O2 and molecular weight 238.19 g/mol. IUPAC: 2-(4-methylcyclohex-3-en-1-yl)propan-2-yl pentanoate.
Chemical Property Profile of 1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯
Property Insights of 1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯
The XLogP value of 3.8 indicates that 1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯 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-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯 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-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯?
The CAS number of 1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯 is 14481-55-1.
What is the molecular formula of 1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯?
The molecular formula of 1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯 is C15H26O2.
What is the molecular weight of 1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯?
The molecular weight of 1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯 is 238.19 g/mol.
Where can I buy 1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯?
You can request a quote for 1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯?
Yes, KEHONG BIO provides custom synthesis services for 1-甲基-1-(4-甲基环己-3-烯基)乙基 戊酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.