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1773-49-5 | Benzaldehyde, 4-methoxy-, 2-(2,4-dinitrophenyl)hydrazone
CAS No: 1773-49-5 Catalog No: AG002582 MDL No:
Product Description
Catalog Number:
AG002582
Chemical Name:
Benzaldehyde, 4-methoxy-, 2-(2,4-dinitrophenyl)hydrazone
CAS Number:
1773-49-5
Molecular Formula:
C14H12N4O5
Molecular Weight:
316.2689
IUPAC Name:
N-[(4-methoxyphenyl)methylideneamino]-2,4-dinitroaniline
InChI:
InChI=1S/C14H12N4O5/c1-23-12-5-2-10(3-6-12)9-15-16-13-7-4-11(17(19)20)8-14(13)18(21)22/h2-9,16H,1H3
InChI Key:
ZWNHWIIWCRFOOW-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C=NNc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
439
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.081g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
316.273g/mol
Monoisotopic Mass:
316.081g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.4
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