(1-Acetylpyrrolidin-2-yl)methyl acetate
TL;DR: (1-Acetylpyrrolidin-2-yl)methyl acetate (CAS 42366-60-9) is a chemical compound with molecular formula C9H15NO3 and molecular weight 185.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-acetylpyrrolidin-2-yl)methyl acetate
Also Known As: (1-acetylpyrrolidin-2-yl)methyl acetate, 2-Acetoxymethyl-1-acetylpyrrolidin, 1-Acetyl-2-(acetoxymethyl)pyrrolidine, (1-Acetyl-2-pyrrolidinyl)methyl acetate #, J3.072.002D
| Molecular Formula | C9H15NO3 |
|---|---|
| Molecular Weight | 185.11 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 185.1052 |
| Heavy Atoms | 13 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 42366-60-9 |
|---|---|
| SMILES | CC(=O)N1CCCC1COC(=O)C |
| InChIKey | BMKZGNGSUYJXAN-UHFFFAOYSA-N |
Product Overview
(1-Acetylpyrrolidin-2-yl)methyl acetate (CAS 42366-60-9), with molecular formula C9H15NO3 and molecular weight 185.11 g/mol. IUPAC: (1-acetylpyrrolidin-2-yl)methyl acetate.
Chemical Property Profile of (1-Acetylpyrrolidin-2-yl)methyl acetate
Property Insights of (1-Acetylpyrrolidin-2-yl)methyl acetate
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-Acetylpyrrolidin-2-yl)methyl acetate. With a topological polar surface area (TPSA) of 46.6 Ų, (1-Acetylpyrrolidin-2-yl)methyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Acetylpyrrolidin-2-yl)methyl 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 (1-Acetylpyrrolidin-2-yl)methyl acetate?
The CAS number of (1-Acetylpyrrolidin-2-yl)methyl acetate is 42366-60-9.
What is the molecular formula of (1-Acetylpyrrolidin-2-yl)methyl acetate?
The molecular formula of (1-Acetylpyrrolidin-2-yl)methyl acetate is C9H15NO3.
What is the molecular weight of (1-Acetylpyrrolidin-2-yl)methyl acetate?
The molecular weight of (1-Acetylpyrrolidin-2-yl)methyl acetate is 185.11 g/mol.
Where can I buy (1-Acetylpyrrolidin-2-yl)methyl acetate?
You can request a quote for (1-Acetylpyrrolidin-2-yl)methyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Acetylpyrrolidin-2-yl)methyl acetate?
Yes, KEHONG BIO provides custom synthesis services for (1-Acetylpyrrolidin-2-yl)methyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.