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Home > Nitro Compounds > 78818-71-0
78818-71-0 | Diazene, [[(2,4-dinitrophenyl)hydrazono]phenylmethyl]phenyl-
CAS No: 78818-71-0 Catalog No: AG0055AW MDL No:
Product Description
Catalog Number:
AG0055AW
Chemical Name:
Diazene, [[(2,4-dinitrophenyl)hydrazono]phenylmethyl]phenyl-
CAS Number:
78818-71-0
Molecular Formula:
C19H14N6O4
Molecular Weight:
390.3523
IUPAC Name:
N'-anilino-N-(2,4-dinitrophenyl)iminobenzenecarboximidamide
InChI:
InChI=1S/C19H14N6O4/c26-24(27)16-11-12-17(18(13-16)25(28)29)21-23-19(14-7-3-1-4-8-14)22-20-15-9-5-2-6-10-15/h1-13,20H
InChI Key:
LOAMGOXBYHVVTL-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1NN=C(c1ccccc1)N=Nc1ccccc1)[N+](=O)[O-]
Properties
Complexity:
617
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
390.108g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
390.359g/mol
Monoisotopic Mass:
390.108g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
141A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.4
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