4-Oxo-pent-2-en-2-yl acetate
TL;DR: 4-Oxo-pent-2-en-2-yl acetate (CAS 4365-63-3) is a chemical compound with molecular formula C7H10O3 and molecular weight 142.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-4-oxopent-2-en-2-yl] acetate
Also Known As: 4-oxopent-2-en-2-yl acetate, 4-Oxo-pent-2-en-2-yl acetate, 4-oxo-pent-2-en-2-ylacetate, 4-(Acetyloxy)-3-penten-2-one, EINECS 255-172-1
| Molecular Formula | C7H10O3 |
|---|---|
| Molecular Weight | 142.06 g/mol |
| LogP | 1.0423 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 142.06299 |
| Heavy Atoms | 10 |
| Complexity | 179.29024 |
Chemical Identifiers
| CAS Number | 4365-63-3 |
|---|---|
| SMILES | C/C(=C\C(=O)C)/OC(=O)C |
Product Overview
4-Oxo-pent-2-en-2-yl acetate (CAS 4365-63-3), with molecular formula C7H10O3 and molecular weight 142.06 g/mol. IUPAC: [(E)-4-oxopent-2-en-2-yl] acetate.
Chemical Property Profile of 4-Oxo-pent-2-en-2-yl acetate
Property Insights of 4-Oxo-pent-2-en-2-yl acetate
The XLogP value of 1.0423 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Oxo-pent-2-en-2-yl acetate. With a topological polar surface area (TPSA) of 43.37 Ų, 4-Oxo-pent-2-en-2-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Oxo-pent-2-en-2-yl acetate 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 4-Oxo-pent-2-en-2-yl acetate?
The CAS number of 4-Oxo-pent-2-en-2-yl acetate is 4365-63-3.
What is the molecular formula of 4-Oxo-pent-2-en-2-yl acetate?
The molecular formula of 4-Oxo-pent-2-en-2-yl acetate is C7H10O3.
What is the molecular weight of 4-Oxo-pent-2-en-2-yl acetate?
The molecular weight of 4-Oxo-pent-2-en-2-yl acetate is 142.06 g/mol.
Where can I buy 4-Oxo-pent-2-en-2-yl acetate?
You can request a quote for 4-Oxo-pent-2-en-2-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Oxo-pent-2-en-2-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-Oxo-pent-2-en-2-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.