Home Aminos 3H-1,2,4-Triazole-3-thione, 5-amino-2,4-dihydro-4-(2-propenyl)-

3H-1,2,4-Triazole-3-thione, 5-amino-2,4-dihydro-4-(2-propenyl)-

CAS No.:
76267-74-8
Catalog Number:
AG005R2K
Molecular Formula:
C5H8N4S
Molecular Weight:
156.2088
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Product Description
Catalog Number:
AG005R2K
Chemical Name:
3H-1,2,4-Triazole-3-thione, 5-amino-2,4-dihydro-4-(2-propenyl)-
CAS Number:
76267-74-8
Molecular Formula:
C5H8N4S
Molecular Weight:
156.2088
MDL Number:
MFCD09971476
IUPAC Name:
3-amino-4-prop-2-enyl-1H-1,2,4-triazole-5-thione
InChI:
InChI=1S/C5H8N4S/c1-2-3-9-4(6)7-8-5(9)10/h2H,1,3H2,(H2,6,7)(H,8,10)
InChI Key:
MLHZAGAUQAYUHA-UHFFFAOYSA-N
SMILES:
Nc1n[nH]c(=S)n1CC=C
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.047g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
156.207g/mol
Monoisotopic Mass:
156.047g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
85.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties