4-Oxazolecarbothioamide


Chemical Name: 4-Oxazolecarbothioamide
CAS Number: 118802-31-6
Product Number: AG003869(AGN-PC-086G7R)
Synonyms:
MDL No:
Molecular Formula: C4H4N2OS
Molecular Weight: 128.1524

Identification/Properties


Computed Properties
Molecular Weight:
128.149g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
128.004g/mol
Monoisotopic Mass:
128.004g/mol
Topological Polar Surface Area:
84.1A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
106
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


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