Home Nitros 1-Methyl-4-nitro-1H-pyrazole-3-carboxamide

1-Methyl-4-nitro-1H-pyrazole-3-carboxamide

CAS No.:
3920-39-6
Catalog Number:
AG00CITP
Molecular Formula:
C5H6N4O3
Molecular Weight:
170.1261
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Product Description
Catalog Number:
AG00CITP
Chemical Name:
1-Methyl-4-nitro-1H-pyrazole-3-carboxamide
CAS Number:
3920-39-6
Molecular Formula:
C5H6N4O3
Molecular Weight:
170.1261
MDL Number:
MFCD02110855
IUPAC Name:
1-methyl-4-nitropyrazole-3-carboxamide
InChI:
InChI=1S/C5H6N4O3/c1-8-2-3(9(11)12)4(7-8)5(6)10/h2H,1H3,(H2,6,10)
InChI Key:
YVMXSLMGSDQURV-UHFFFAOYSA-N
SMILES:
Cn1nc(c(c1)[N+](=O)[O-])C(=O)N
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.044g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.128g/mol
Monoisotopic Mass:
170.044g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties