2-Butenoic acid, 3-methyl-, decyl ester
TL;DR: 2-Butenoic acid, 3-methyl-, decyl ester (CAS 56500-46-0) is a chemical compound with molecular formula C15H28O2 and molecular weight 240.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
decyl 3-methylbut-2-enoate
Also Known As: decyl 3-methylbut-2-enoate, Decyl 3-methyl-2-butenoate, Decyl 3-methyl-2-butenoate #, 2-Butenoic acid, 3-methyl-, decyl ester, 3-Methyl-2-butenoic acid, decyl ester
| Molecular Formula | C15H28O2 |
|---|---|
| Molecular Weight | 240.21 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 240.20892 |
| Heavy Atoms | 17 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 56500-46-0 |
|---|---|
| SMILES | CCCCCCCCCCOC(=O)C=C(C)C |
| InChIKey | CCXPZXOKHQNDHA-UHFFFAOYSA-N |
Product Overview
2-Butenoic acid, 3-methyl-, decyl ester (CAS 56500-46-0), with molecular formula C15H28O2 and molecular weight 240.21 g/mol. IUPAC: decyl 3-methylbut-2-enoate.
Chemical Property Profile of 2-Butenoic acid, 3-methyl-, decyl ester
Property Insights of 2-Butenoic acid, 3-methyl-, decyl ester
The XLogP value of 5.9 indicates that 2-Butenoic acid, 3-methyl-, decyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Butenoic acid, 3-methyl-, decyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butenoic acid, 3-methyl-, decyl ester has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Butenoic acid, 3-methyl-, decyl ester?
The CAS number of 2-Butenoic acid, 3-methyl-, decyl ester is 56500-46-0.
What is the molecular formula of 2-Butenoic acid, 3-methyl-, decyl ester?
The molecular formula of 2-Butenoic acid, 3-methyl-, decyl ester is C15H28O2.
What is the molecular weight of 2-Butenoic acid, 3-methyl-, decyl ester?
The molecular weight of 2-Butenoic acid, 3-methyl-, decyl ester is 240.21 g/mol.
Where can I buy 2-Butenoic acid, 3-methyl-, decyl ester?
You can request a quote for 2-Butenoic acid, 3-methyl-, decyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butenoic acid, 3-methyl-, decyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Butenoic acid, 3-methyl-, decyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.