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10220-27-6 | 4-Thiazolidinone, 2-phenyl-
CAS No: 10220-27-6 Catalog No: AG0006VU MDL No:
Product Description
Catalog Number:
AG0006VU
Chemical Name:
4-Thiazolidinone, 2-phenyl-
CAS Number:
10220-27-6
Molecular Formula:
C9H9NOS
Molecular Weight:
179.2389
IUPAC Name:
2-phenyl-1,3-thiazolidin-4-one
InChI:
InChI=1S/C9H9NOS/c11-8-6-12-9(10-8)7-4-2-1-3-5-7/h1-5,9H,6H2,(H,10,11)
InChI Key:
ZMOOFKQWPDBUEM-UHFFFAOYSA-N
SMILES:
O=C1CSC(N1)c1ccccc1
NSC Number:
153119
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.04g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.237g/mol
Monoisotopic Mass:
179.04g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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