Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)-
TL;DR: Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)- (CAS 57022-74-9) 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.
[(2E,4E)-deca-2,4-dienyl] 3-methylbutanoate
Also Known As: (2E,4E)-Deca-2,4-dienyl isovalerate, EINECS 260-346-5, EINECS 260-522-1, (2E,4Z)-Deca-2,4-dienyl isovalerate, Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)-
| Molecular Formula | C15H26O2 |
|---|---|
| Molecular Weight | 238.19 g/mol |
| LogP | 4.2684 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 238.19328 |
| Heavy Atoms | 17 |
| Complexity | 239.30638 |
Chemical Identifiers
| CAS Number | 57022-74-9 |
|---|---|
| SMILES | CCCCC/C=C/C=C/COC(=O)CC(C)C |
Product Overview
Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)- (CAS 57022-74-9), with molecular formula C15H26O2 and molecular weight 238.19 g/mol. IUPAC: [(2E,4E)-deca-2,4-dienyl] 3-methylbutanoate.
Chemical Property Profile of Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)-
Property Insights of Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)-
The XLogP value of 4.2684 indicates that Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)- 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 Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)-?
The CAS number of Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)- is 57022-74-9.
What is the molecular formula of Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)-?
The molecular formula of Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)- is C15H26O2.
What is the molecular weight of Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)-?
The molecular weight of Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)- is 238.19 g/mol.
Where can I buy Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)-?
You can request a quote for Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)-?
Yes, KEHONG BIO provides custom synthesis services for Butanoic acid, 3-methyl-, 2,4-decadienyl ester, (E,E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.