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24340-75-8 | 4-ISOTHIAZOLECARBOXAMIDE
CAS No: 24340-75-8 Catalog No: AG007NS2 MDL No:MFCD19205884
Product Description
Catalog Number:
AG007NS2
Chemical Name:
4-ISOTHIAZOLECARBOXAMIDE
CAS Number:
24340-75-8
Molecular Formula:
C4H4N2OS
Molecular Weight:
128.1524
MDL Number:
MFCD19205884
IUPAC Name:
1,2-thiazole-4-carboxamide
InChI:
InChI=1S/C4H4N2OS/c5-4(7)3-1-6-8-2-3/h1-2H,(H2,5,7)
InChI Key:
BEPMYBTTZSNHPS-UHFFFAOYSA-N
SMILES:
NC(=O)c1csnc1
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.004g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
128.149g/mol
Monoisotopic Mass:
128.004g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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