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2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid structure
Fine Chemical

2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid

TL;DR: 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid (CAS 106040-00-0) is a chemical compound with molecular formula C6H9NO3S and molecular weight 175.03032 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(5-oxopyrrolidin-2-yl)sulfanylacetic acid

Also Known As: Bionet2_000955, 2-[(5-oxo-2-pyrrolidinyl)sulfanyl]acetic acid, 2-[(5-oxopyrrolidin-2-yl)sulfanyl]acetic acid, 2-(5-oxopyrrolidin-2-yl)sulfanylacetic acid, [(5-oxo-2-pyrrolidinyl)thio]acetic acid

CAS Number
106040-00-0
Molecular Formula
C6H9NO3S
Molecular Weight
175.03032 g/mol
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Technical Specifications

Molecular FormulaC6H9NO3S
Molecular Weight175.03032 g/mol
XLogP0.0
Topological Polar Surface Area (TPSA)91.7 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds3
Exact Mass175.03032 Da
Heavy Atoms11
Complexity183.0
SMILESC1CC(=O)NC1SCC(=O)O
InChIKeyQOPHSAZRWBCIQA-UHFFFAOYSA-N

Chemical Property Profile of 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid

XLogP
0.0
TPSA (Topological Polar Surface Area)
91.7
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
3
Heavy Atoms
11
Complexity
183.0
Exact Mass
175.03032
Monoisotopic Mass
175.03032
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid

The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid. The TPSA of 91.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid. Following Lipinski's Rule of Five, 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid?

The CAS number of 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid is 106040-00-0.

What is the molecular formula of 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid?

The molecular formula of 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid is C6H9NO3S.

What is the molecular weight of 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid?

The molecular weight of 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid is 175.03032 g/mol.

Where can I buy 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid?

You can request a quote for 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid?

Yes, CoreyChem provides custom synthesis services for 2-[(5-Oxo-2-pyrrolidinyl)sulfanyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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