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19967-65-8 | 4-IMINO-1,3-THIAZOLIDIN-2-ONE
CAS No: 19967-65-8 Catalog No: AG00BD09 MDL No:MFCD00154755
Product Description
Catalog Number:
AG00BD09
Chemical Name:
4-IMINO-1,3-THIAZOLIDIN-2-ONE
CAS Number:
19967-65-8
Molecular Formula:
C3H4N2OS
Molecular Weight:
116.1417
MDL Number:
MFCD00154755
IUPAC Name:
4-amino-5H-1,3-thiazol-2-one
InChI:
InChI=1S/C3H4N2OS/c4-2-1-7-3(6)5-2/h1H2,(H2,4,5,6)
InChI Key:
PECKLIXQHBFLKD-UHFFFAOYSA-N
SMILES:
N=C1CSC(=O)N1
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.004g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
116.138g/mol
Monoisotopic Mass:
116.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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