5-Oxazolecarbothioamide


Chemical Name: 5-Oxazolecarbothioamide
CAS Number: 885274-32-8
Product Number: AG0046CT(AGN-PC-09Q638)
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


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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