5-Acetoxymethyl-N-acetyl-2-pyrrolidinone
TL;DR: 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone (CAS 887352-10-5) is a chemical compound with molecular formula C9H13NO4 and molecular weight 199.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-acetyl-5-oxopyrrolidin-2-yl)methyl acetate
Also Known As: 5-ACETOXYMETHYL-N-ACETYL-2-PYRROLIDINONE, (1-acetyl-5-oxopyrrolidin-2-yl)methyl acetate, 1-Acetyl-5-[(acetyloxy)methyl]-2-pyrrolidinone, (1-acetyl-5-oxo-pyrrolidin-2-yl)methyl Acetate
| Molecular Formula | C9H13NO4 |
|---|---|
| Molecular Weight | 199.08 g/mol |
| LogP | 0.087 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.08446 |
| Heavy Atoms | 14 |
| Complexity | 273.98553 |
Chemical Identifiers
| CAS Number | 887352-10-5 |
|---|---|
| SMILES | CC(=O)N1C(CCC1=O)COC(=O)C |
Product Overview
5-Acetoxymethyl-N-acetyl-2-pyrrolidinone (CAS 887352-10-5), with molecular formula C9H13NO4 and molecular weight 199.08 g/mol. IUPAC: (1-acetyl-5-oxopyrrolidin-2-yl)methyl acetate.
Chemical Property Profile of 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone
Property Insights of 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone
The XLogP value of 0.087 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone. Following Lipinski's Rule of Five, 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone 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 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone?
The CAS number of 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone is 887352-10-5.
What is the molecular formula of 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone?
The molecular formula of 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone is C9H13NO4.
What is the molecular weight of 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone?
The molecular weight of 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone is 199.08 g/mol.
Where can I buy 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone?
You can request a quote for 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone?
Yes, KEHONG BIO provides custom synthesis services for 5-Acetoxymethyl-N-acetyl-2-pyrrolidinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.