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317803-03-5

317803-03-5 | 2-Thiazolidin-3-ylethanethiol

CAS No: 317803-03-5 Catalog No: AG019DM1 MDL No:MFCD04037372

Product Description

Catalog Number:
AG019DM1
Chemical Name:
2-Thiazolidin-3-ylethanethiol
CAS Number:
317803-03-5
Molecular Formula:
C5H11NS2
Molecular Weight:
149.2775
MDL Number:
MFCD04037372
IUPAC Name:
2-(1,3-thiazolidin-3-yl)ethanethiol
InChI:
InChI=1S/C5H11NS2/c7-3-1-6-2-4-8-5-6/h7H,1-5H2
InChI Key:
QZSFSYKRUWBUHJ-UHFFFAOYSA-N
SMILES:
SCCN1CSCC1

Properties

Complexity:
67.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.033g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
149.27g/mol
Monoisotopic Mass:
149.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

Literature

Title Journal
Structural determination and odor characterization of N-(2-mercaptoethyl)-1,3-thiazolidine, a new intense popcorn-like-smelling odorant. Journal of agricultural and food chemistry 20020911
Identification and quantitation of key aroma compounds formed in Maillard-type reactions of fructose with cysteamine or isothiaproline (1,3-thiazolidine-2-carboxylic acid). Journal of agricultural and food chemistry 20020911

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