Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester
TL;DR: Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester (CAS 102597-03-5) is a chemical compound with molecular formula C21H25NO2 and molecular weight 323.18854 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1-methylpyrrolidin-2-yl)ethyl 2,2-diphenylacetate
Also Known As: BRL 373, Diphenylacetic acid 2-(1-methyl-2-pyrrolidinyl)ethyl ester, 4-21-00-00080 (Beilstein Handbook Reference), 2-(1-Methylpyrrolidin-2-yl)ethyl diphenylacetate, ACETIC ACID, DIPHENYL-, 2-(1-METHYL-2-PYRROLIDINYL)ETHYL ESTER
Technical Specifications
| Molecular Formula | C21H25NO2 |
| Molecular Weight | 323.18854 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 323.18854 Da |
| Heavy Atoms | 24 |
| Complexity | 367.0 |
| SMILES | CN1CCCC1CCOC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | PVSHEWUMRADDHZ-UHFFFAOYSA-N |
Chemical Property Profile of Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester
Property Insights of Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester
The XLogP value of 4.4 indicates that Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester 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
What is the CAS number of Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester?
The CAS number of Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester is 102597-03-5.
What is the molecular formula of Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester?
The molecular formula of Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester is C21H25NO2.
What is the molecular weight of Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester?
The molecular weight of Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester is 323.18854 g/mol.
Where can I buy Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester?
You can request a quote for Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester?
Yes, CoreyChem provides custom synthesis services for Acetic acid, diphenyl-, 2-(1-methyl-2-pyrrolidinyl)ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.