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Home > Nitro Compounds > 1237-69-0
1237-69-0 | 2-Propenal, 3-phenyl-, 2-(2,4-dinitrophenyl)hydrazone
CAS No: 1237-69-0 Catalog No: AG000KZ7 MDL No:
Product Description
Catalog Number:
AG000KZ7
Chemical Name:
2-Propenal, 3-phenyl-, 2-(2,4-dinitrophenyl)hydrazone
CAS Number:
1237-69-0
Molecular Formula:
C15H12N4O4
Molecular Weight:
312.2802
IUPAC Name:
N-(cinnamylideneamino)-2,4-dinitroaniline
InChI:
InChI=1S/C15H12N4O4/c20-18(21)13-8-9-14(15(11-13)19(22)23)17-16-10-4-7-12-5-2-1-3-6-12/h1-11,17H
InChI Key:
RLSRMSQNTNYDMC-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1NN=CC=Cc1ccccc1)[N+](=O)[O-]
Properties
Complexity:
463
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.086g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
312.285g/mol
Monoisotopic Mass:
312.086g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
2.9
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