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89612-09-9 | 5-Thiazolidinone, 2-imino-3-phenyl-
CAS No: 89612-09-9 Catalog No: AG003WQF MDL No:
Product Description
Catalog Number:
AG003WQF
Chemical Name:
5-Thiazolidinone, 2-imino-3-phenyl-
CAS Number:
89612-09-9
Molecular Formula:
C9H8N2OS
Molecular Weight:
192.2376
IUPAC Name:
2-imino-3-phenyl-1,3-thiazolidin-5-one
InChI:
InChI=1S/C9H8N2OS/c10-9-11(6-8(12)13-9)7-4-2-1-3-5-7/h1-5,10H,6H2
InChI Key:
BJCAFHODPZYKLI-UHFFFAOYSA-N
SMILES:
N=C1SC(=O)CN1c1ccccc1
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.036g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.236g/mol
Monoisotopic Mass:
192.036g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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