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Home > Nitro Compounds > 88480-48-2
88480-48-2 | Butanamide, N-cyclohexyl-4-[(4-nitrophenyl)hydrazono]-
CAS No: 88480-48-2 Catalog No: AG004AFF MDL No:
Product Description
Catalog Number:
AG004AFF
Chemical Name:
Butanamide, N-cyclohexyl-4-[(4-nitrophenyl)hydrazono]-
CAS Number:
88480-48-2
Molecular Formula:
C16H22N4O3
Molecular Weight:
318.3709
IUPAC Name:
N-cyclohexyl-4-[(4-nitrophenyl)hydrazinylidene]butanamide
InChI:
InChI=1S/C16H22N4O3/c21-16(18-13-5-2-1-3-6-13)7-4-12-17-19-14-8-10-15(11-9-14)20(22)23/h8-13,19H,1-7H2,(H,18,21)
InChI Key:
OXJWAVBNSZESIK-UHFFFAOYSA-N
SMILES:
O=C(NC1CCCCC1)CCC=NNc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.169g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
318.377g/mol
Monoisotopic Mass:
318.169g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
99.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.7
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