Home Nitriles 5-amino-1,3,4-thiadiazole-2-carbonitrile

5-amino-1,3,4-thiadiazole-2-carbonitrile

CAS No.:
1782071-20-8
Catalog Number:
AG01DYWW
Molecular Formula:
C3H2N4S
Molecular Weight:
126.1398
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Product Description
Catalog Number:
AG01DYWW
Chemical Name:
5-amino-1,3,4-thiadiazole-2-carbonitrile
CAS Number:
1782071-20-8
Molecular Formula:
C3H2N4S
Molecular Weight:
126.1398
MDL Number:
MFCD29761748
IUPAC Name:
5-amino-1,3,4-thiadiazole-2-carbonitrile
InChI:
InChI=1S/C3H2N4S/c4-1-2-6-7-3(5)8-2/h(H2,5,7)
InChI Key:
YWGJXGCTEPVJNM-UHFFFAOYSA-N
SMILES:
Nc1nnc(s1)C#N
Properties
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
126.137g/mol
Monoisotopic Mass:
126g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties