![2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)- structure](/static/products/5331/53311-39-0.webp)
2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)-
TL;DR: 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)- (CAS 53311-39-0) is a chemical compound with molecular formula C16H28O3 and molecular weight 268.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (E)-3-methyl-5-(6-methylhept-5-en-2-yloxy)pent-2-enoate
Also Known As: (E)-5-[(1,5-Dimethyl-4-hexenyl)oxy]-3-methyl-2-pentenoic acid ethyl ester, 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)-, Ethyl (2E)-5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-2-pentenoate, ethyl (E)-3-methyl-5-(6-methylhept-5-en-2-yloxy)pent-2-enoate, ethyl (2E)-3-methyl-5-[(6-methylhept-5-en-2-yl)oxy]pent-2-enoate
| Molecular Formula | C16H28O3 |
|---|---|
| Molecular Weight | 268.20 g/mol |
| LogP | 4.0374 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 268.20386 |
| Heavy Atoms | 19 |
| Complexity | 311.95575 |
Chemical Identifiers
| CAS Number | 53311-39-0 |
|---|---|
| SMILES | CCOC(=O)/C=C(\C)/CCOC(C)CCC=C(C)C |
Product Overview
2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)- (CAS 53311-39-0), with molecular formula C16H28O3 and molecular weight 268.20 g/mol. IUPAC: ethyl (E)-3-methyl-5-(6-methylhept-5-en-2-yloxy)pent-2-enoate.
Chemical Property Profile of 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)-
Property Insights of 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)-
The XLogP value of 4.0374 indicates that 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)- has 0 hydrogen bond donor(s) and 3 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-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)-?
The CAS number of 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)- is 53311-39-0.
What is the molecular formula of 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)-?
The molecular formula of 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)- is C16H28O3.
What is the molecular weight of 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)-?
The molecular weight of 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)- is 268.20 g/mol.
Where can I buy 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)-?
You can request a quote for 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pentenoic acid, 5-[(1,5-dimethyl-4-hexenyl)oxy]-3-methyl-, ethyl ester, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.