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Home > Nitro Compounds > 1174906-82-1
1174906-82-1 | 1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
CAS No: 1174906-82-1 Catalog No: AG01BDDW MDL No:MFCD09701471
Product Description
Catalog Number:
AG01BDDW
Chemical Name:
1-ethyl-4-nitro-1H-pyrazole-3-carboxamide
CAS Number:
1174906-82-1
Molecular Formula:
C6H8N4O3
Molecular Weight:
184.1527
MDL Number:
MFCD09701471
IUPAC Name:
1-ethyl-4-nitropyrazole-3-carboxamide
InChI:
InChI=1S/C6H8N4O3/c1-2-9-3-4(10(12)13)5(8-9)6(7)11/h3H,2H2,1H3,(H2,7,11)
InChI Key:
RIWSEYIPUTZQBS-UHFFFAOYSA-N
SMILES:
CCn1nc(c(c1)[N+](=O)[O-])C(=O)N
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.06g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
184.155g/mol
Monoisotopic Mass:
184.06g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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