N-Acetyl-4-thiazolidinecarboxylic acid

C₆H₉NO₃SCAS 5025-82-1175.20 g/mol

Open in Covalent MOL file

Alcohol Amide Carboxylic Acid Sulfide

Properties

Molecular formula: C₆H₉NO₃S
Molar mass: 175.20 g/mol
Exact mass: 175.0303 Da
Melting point: 146–148 °C
logP: -0.01Crippen estimate
Polar surface area: 57.6 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Identifiers

CAS number

5025-82-1

SMILES

CC(=O)N1CSCC1C(=O)O

InChIKey

WXTBYSIPOKXCPM-UHFFFAOYSA-N

InChI

InChI=1S/C6H9NO3S/c1-4(8)7-3-11-2-5(7)6(9)10/h5H,2-3H2,1H3,(H,9,10)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

9 names

4-Thiazolidinecarboxylic acid, 3-acetyl-
3-Acetyl-4-thiazolidinecarboxylic acid
Aminofol
ATCA
NSC 146111
N-Acetyl-1,3-thiazolidine-4-carboxylic acid
Fantac
Fantac plus
3-Acetyl-1,3-thiazolidine-4-carboxylic acid

Work with N-Acetyl-4-thiazolidinecarboxylic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

(4R)-3-Acetyl-4-thiazolidinecarboxylic acid54323-50-1

Elsewhere

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