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2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid structure
Fine Chemical

2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid

TL;DR: 2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid (CAS 1059732-17-0) is a chemical compound with molecular formula C8H15NO5S and molecular weight 237.0671 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[(4-hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid

Also Known As: 2-(4-Hydroxy-1,1-dioxo-tetrahydro-1lambda*6*-thiophen-3-ylamino)-butyric acid, 1-Benzylpiperidin-3-ol hydrochloride, 8278AC, BAS 03320844, 2-[(4-hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid

CAS Number
1059732-17-0
Molecular Formula
C8H15NO5S
Molecular Weight
237.0671 g/mol
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Technical Specifications

Molecular FormulaC8H15NO5S
Molecular Weight237.0671 g/mol
XLogP-3.4
Topological Polar Surface Area (TPSA)112.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors6
Rotatable Bonds4
Exact Mass237.0671 Da
Heavy Atoms15
Complexity333.0
SMILESCCC(C(=O)O)NC1CS(=O)(=O)CC1O
InChIKeyBSZFUFJEQWHURV-UHFFFAOYSA-N

Chemical Property Profile of 2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid

XLogP
-3.4
TPSA (Topological Polar Surface Area)
112.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
6
Rotatable Bonds
4
Heavy Atoms
15
Complexity
333.0
Exact Mass
237.0671
Monoisotopic Mass
237.0671
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-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid

The XLogP value of -3.4 indicates that 2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid. Following Lipinski's Rule of Five, 2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid has 3 hydrogen bond donor(s) and 6 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-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid?

The CAS number of 2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid is 1059732-17-0.

What is the molecular formula of 2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid?

The molecular formula of 2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid is C8H15NO5S.

What is the molecular weight of 2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid?

The molecular weight of 2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid is 237.0671 g/mol.

Where can I buy 2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid?

You can request a quote for 2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid?

Yes, CoreyChem provides custom synthesis services for 2-[(4-Hydroxy-1,1-dioxothiolan-3-yl)amino]butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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