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Home > Nitro Compounds > 2057-87-6
2057-87-6 | Cyclopentanone, 2-(2,4-dinitrophenyl)hydrazone
CAS No: 2057-87-6 Catalog No: AG002AAQ MDL No:
Product Description
Catalog Number:
AG002AAQ
Chemical Name:
Cyclopentanone, 2-(2,4-dinitrophenyl)hydrazone
CAS Number:
2057-87-6
Molecular Formula:
C11H12N4O4
Molecular Weight:
264.2374
IUPAC Name:
N-(cyclopentylideneamino)-2,4-dinitroaniline
InChI:
InChI=1S/C11H12N4O4/c16-14(17)9-5-6-10(11(7-9)15(18)19)13-12-8-3-1-2-4-8/h5-7,13H,1-4H2
InChI Key:
PWMLZJHXUHLKPB-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1NN=C1CCCC1)[N+](=O)[O-]
NSC Number:
25014
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.086g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
264.241g/mol
Monoisotopic Mass:
264.086g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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