(3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate
TL;DR: (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate (CAS 367251-87-4) is a chemical compound with molecular formula C9H11NO4 and molecular weight 197.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S)-2,5-dioxo-1-prop-2-enylpyrrolidin-3-yl] acetate
Also Known As: (3S)-1-Allyl-3beta-acetoxypyrrolidine-2,5-dione, J1.553.749C, (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate, [(3S)-2,5-dioxo-1-prop-2-enylpyrrolidin-3-yl] acetate, (3S)-3-(Acetyloxy)-1-(2-propen-1-yl)-2,5-pyrrolidinedione
| Molecular Formula | C9H11NO4 |
|---|---|
| Molecular Weight | 197.07 g/mol |
| LogP | -0.137 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 197.0688 |
| Heavy Atoms | 14 |
| Complexity | 297.18707 |
Chemical Identifiers
| CAS Number | 367251-87-4 |
|---|---|
| SMILES | CC(=O)O[C@H]1CC(=O)N(C1=O)CC=C |
Product Overview
(3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate (CAS 367251-87-4), with molecular formula C9H11NO4 and molecular weight 197.07 g/mol. IUPAC: [(3S)-2,5-dioxo-1-prop-2-enylpyrrolidin-3-yl] acetate.
Chemical Property Profile of (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate
Property Insights of (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate
The XLogP value of -0.137 indicates that (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate. Following Lipinski's Rule of Five, (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate 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 (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate?
The CAS number of (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate is 367251-87-4.
What is the molecular formula of (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate?
The molecular formula of (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate is C9H11NO4.
What is the molecular weight of (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate?
The molecular weight of (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate is 197.07 g/mol.
Where can I buy (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate?
You can request a quote for (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate?
Yes, KEHONG BIO provides custom synthesis services for (3S)-2,5-dioxo-1-(prop-2-en-1-yl)pyrrolidin-3-yl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.