2-Butenoic acid, 2-propenylidene ester
TL;DR: 2-Butenoic acid, 2-propenylidene ester (CAS 5408-76-4) is a chemical compound with molecular formula C11H14O4 and molecular weight 210.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-but-2-enoyl]oxyprop-2-enyl (E)-but-2-enoate
Also Known As: 2-Butenoic acid, 2-propenylidene ester, Bis(2-butenoic acid)2-propenylidene ester, Prop-1-ene-3,3-diyl di[(2E)-but-2-enoate], 1-(but-2-enoyloxy)prop-2-en-1-yl but-2-enoate, 1-[(E)-but-2-enoyl]oxyprop-2-enyl (E)-but-2-enoate
| Molecular Formula | C11H14O4 |
|---|---|
| Molecular Weight | 210.09 g/mol |
| LogP | 1.7371 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 210.0892 |
| Heavy Atoms | 15 |
| Complexity | 262.96304 |
Chemical Identifiers
| CAS Number | 5408-76-4 |
|---|---|
| SMILES | C/C=C/C(=O)OC(OC(=O)/C=C/C)C=C |
Product Overview
2-Butenoic acid, 2-propenylidene ester (CAS 5408-76-4), with molecular formula C11H14O4 and molecular weight 210.09 g/mol. IUPAC: 1-[(E)-but-2-enoyl]oxyprop-2-enyl (E)-but-2-enoate.
Chemical Property Profile of 2-Butenoic acid, 2-propenylidene ester
Property Insights of 2-Butenoic acid, 2-propenylidene ester
The XLogP value of 1.7371 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butenoic acid, 2-propenylidene ester. With a topological polar surface area (TPSA) of 52.6 Ų, 2-Butenoic acid, 2-propenylidene ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butenoic acid, 2-propenylidene ester has 0 hydrogen bond donor(s) and 4 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-Butenoic acid, 2-propenylidene ester?
The CAS number of 2-Butenoic acid, 2-propenylidene ester is 5408-76-4.
What is the molecular formula of 2-Butenoic acid, 2-propenylidene ester?
The molecular formula of 2-Butenoic acid, 2-propenylidene ester is C11H14O4.
What is the molecular weight of 2-Butenoic acid, 2-propenylidene ester?
The molecular weight of 2-Butenoic acid, 2-propenylidene ester is 210.09 g/mol.
Where can I buy 2-Butenoic acid, 2-propenylidene ester?
You can request a quote for 2-Butenoic acid, 2-propenylidene 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, 2-propenylidene ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Butenoic acid, 2-propenylidene ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.