Butanoic acid, (2E)-2-butenyl ester
TL;DR: Butanoic acid, (2E)-2-butenyl ester (CAS 20279-26-9) is a chemical compound with molecular formula C8H14O2 and molecular weight 142.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-2-enyl butanoate
Also Known As: crotyl butyrate, Butanoic acid, (2E)-2-butenyl ester, BUT-2-EN-1-YL BUTANOATE, RefChem:330658
| Molecular Formula | C8H14O2 |
|---|---|
| Molecular Weight | 142.10 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 142.09938 |
| Heavy Atoms | 10 |
| Complexity | 116.0 |
Chemical Identifiers
| CAS Number | 20279-26-9 |
|---|---|
| SMILES | CCCC(=O)OCC=CC |
| InChIKey | RTMMLEZUIUUHHW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butanoic acid, (2E)-2-butenyl ester (CAS 20279-26-9), with molecular formula C8H14O2 and molecular weight 142.10 g/mol. IUPAC: but-2-enyl butanoate.
Chemical Property Profile of Butanoic acid, (2E)-2-butenyl ester
Property Insights of Butanoic acid, (2E)-2-butenyl ester
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanoic acid, (2E)-2-butenyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, Butanoic acid, (2E)-2-butenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butanoic acid, (2E)-2-butenyl ester 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, (2E)-2-butenyl ester?
The CAS number of Butanoic acid, (2E)-2-butenyl ester is 20279-26-9.
What is the molecular formula of Butanoic acid, (2E)-2-butenyl ester?
The molecular formula of Butanoic acid, (2E)-2-butenyl ester is C8H14O2.
What is the molecular weight of Butanoic acid, (2E)-2-butenyl ester?
The molecular weight of Butanoic acid, (2E)-2-butenyl ester is 142.10 g/mol.
Where can I buy Butanoic acid, (2E)-2-butenyl ester?
You can request a quote for Butanoic acid, (2E)-2-butenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butanoic acid, (2E)-2-butenyl ester?
Yes, KEHONG BIO provides custom synthesis services for Butanoic acid, (2E)-2-butenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.