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380442-86-4

380442-86-4 | 2-[(2,6-dimethylphenyl)imino]-1,3-thiazolidin-4-one

CAS No: 380442-86-4 Catalog No: AG019H7V MDL No:MFCD06654909

Product Description

Catalog Number:
AG019H7V
Chemical Name:
2-[(2,6-dimethylphenyl)imino]-1,3-thiazolidin-4-one
CAS Number:
380442-86-4
Molecular Formula:
C11H12N2OS
Molecular Weight:
220.2908
MDL Number:
MFCD06654909
IUPAC Name:
2-(2,6-dimethylphenyl)imino-1,3-thiazolidin-4-one
InChI:
InChI=1S/C11H12N2OS/c1-7-4-3-5-8(2)10(7)13-11-12-9(14)6-15-11/h3-5H,6H2,1-2H3,(H,12,13,14)
InChI Key:
FBQWEQNQNVYRKS-UHFFFAOYSA-N
SMILES:
O=C1CSC(=Nc2c(C)cccc2C)N1

Properties

Complexity:
280  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.067g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.29g/mol
Monoisotopic Mass:
220.067g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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