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Home > Nitro Compounds > 1555-81-3
1555-81-3 | 2-Propanone, 1,3-diphenyl-, (2,4-dinitrophenyl)hydrazone
CAS No: 1555-81-3 Catalog No: AG001NYM MDL No:
Product Description
Catalog Number:
AG001NYM
Chemical Name:
2-Propanone, 1,3-diphenyl-, (2,4-dinitrophenyl)hydrazone
CAS Number:
1555-81-3
Molecular Formula:
C21H18N4O4
Molecular Weight:
390.3920
IUPAC Name:
N-(1,3-diphenylpropan-2-ylideneamino)-2,4-dinitroaniline
InChI:
InChI=1S/C21H18N4O4/c26-24(27)19-11-12-20(21(15-19)25(28)29)23-22-18(13-16-7-3-1-4-8-16)14-17-9-5-2-6-10-17/h1-12,15,23H,13-14H2
InChI Key:
SADKVEXCBRVUFS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1NN=C(Cc1ccccc1)Cc1ccccc1)[N+](=O)[O-]
NSC Number:
230203
Properties
Complexity:
552
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
390.133g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
390.399g/mol
Monoisotopic Mass:
390.133g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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