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108654-36-0

108654-36-0 | 3-(2,3-dimethylphenyl)-2-thioxo-1,3-thiazolidin-4-one

CAS No: 108654-36-0 Catalog No: AG00J75Q MDL No:MFCD00175320

Product Description

Catalog Number:
AG00J75Q
Chemical Name:
3-(2,3-dimethylphenyl)-2-thioxo-1,3-thiazolidin-4-one
CAS Number:
108654-36-0
Molecular Formula:
C11H11NOS2
Molecular Weight:
237.3411
MDL Number:
MFCD00175320
IUPAC Name:
3-(2,3-dimethylphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C11H11NOS2/c1-7-4-3-5-9(8(7)2)12-10(13)6-15-11(12)14/h3-5H,6H2,1-2H3
InChI Key:
FVQWFYNWBZZMII-UHFFFAOYSA-N
SMILES:
O=C1CSC(=S)N1c1cccc(c1C)C

Properties

Complexity:
292  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.028g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.335g/mol
Monoisotopic Mass:
237.028g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
77.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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