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1457-47-2

1457-47-2 | 4-Thiazolidinone, 3-(2-propen-1-yl)-2-thioxo-

CAS No: 1457-47-2 Catalog No: AG001DBY MDL No:MFCD00044700

Product Description

Catalog Number:
AG001DBY
Chemical Name:
4-Thiazolidinone, 3-(2-propen-1-yl)-2-thioxo-
CAS Number:
1457-47-2
Molecular Formula:
C6H7NOS2
Molecular Weight:
173.2559
MDL Number:
MFCD00044700
IUPAC Name:
3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C6H7NOS2/c1-2-3-7-5(8)4-10-6(7)9/h2H,1,3-4H2
InChI Key:
GYGUTBCTEJBRAN-UHFFFAOYSA-N
SMILES:
C=CCN1C(=S)SCC1=O
EC Number:
215-941-4
NSC Number:
43395

Properties

Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.997g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.248g/mol
Monoisotopic Mass:
172.997g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
77.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

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