Prop-2-enyl 2-acetylpent-4-enoate
TL;DR: Prop-2-enyl 2-acetylpent-4-enoate (CAS 90926-79-7) is a chemical compound with molecular formula C10H14O3 and molecular weight 182.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 2-acetylpent-4-enoate
Also Known As: prop-2-enyl 2-acetylpent-4-enoate, prop-2-en-1-yl 2-acetylpent-4-enoate, 2-Acetyl-4-pentenoic acid allyl ester, J1.448.907J, RefChem:373882
| Molecular Formula | C10H14O3 |
|---|---|
| Molecular Weight | 182.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 182.0943 |
| Heavy Atoms | 13 |
| Complexity | 218.0 |
Chemical Identifiers
| CAS Number | 90926-79-7 |
|---|---|
| SMILES | CC(=O)C(CC=C)C(=O)OCC=C |
| InChIKey | HSOONMNVUKOHJZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Prop-2-enyl 2-acetylpent-4-enoate (CAS 90926-79-7), with molecular formula C10H14O3 and molecular weight 182.09 g/mol. IUPAC: prop-2-enyl 2-acetylpent-4-enoate.
Chemical Property Profile of Prop-2-enyl 2-acetylpent-4-enoate
Property Insights of Prop-2-enyl 2-acetylpent-4-enoate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Prop-2-enyl 2-acetylpent-4-enoate. With a topological polar surface area (TPSA) of 43.4 Ų, Prop-2-enyl 2-acetylpent-4-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Prop-2-enyl 2-acetylpent-4-enoate 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 Prop-2-enyl 2-acetylpent-4-enoate?
The CAS number of Prop-2-enyl 2-acetylpent-4-enoate is 90926-79-7.
What is the molecular formula of Prop-2-enyl 2-acetylpent-4-enoate?
The molecular formula of Prop-2-enyl 2-acetylpent-4-enoate is C10H14O3.
What is the molecular weight of Prop-2-enyl 2-acetylpent-4-enoate?
The molecular weight of Prop-2-enyl 2-acetylpent-4-enoate is 182.09 g/mol.
Where can I buy Prop-2-enyl 2-acetylpent-4-enoate?
You can request a quote for Prop-2-enyl 2-acetylpent-4-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Prop-2-enyl 2-acetylpent-4-enoate?
Yes, KEHONG BIO provides custom synthesis services for Prop-2-enyl 2-acetylpent-4-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.