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Home > Nitro Compounds > 89196-83-8
89196-83-8 | Benzene, 1,1'-(dinitromethylene)bis[4-methyl-
CAS No: 89196-83-8 Catalog No: AG004NEH MDL No:
Product Description
Catalog Number:
AG004NEH
Chemical Name:
Benzene, 1,1'-(dinitromethylene)bis[4-methyl-
CAS Number:
89196-83-8
Molecular Formula:
C15H14N2O4
Molecular Weight:
286.2827
IUPAC Name:
1-methyl-4-[(4-methylphenyl)-dinitromethyl]benzene
InChI:
InChI=1S/C15H14N2O4/c1-11-3-7-13(8-4-11)15(16(18)19,17(20)21)14-9-5-12(2)6-10-14/h3-10H,1-2H3
InChI Key:
NEVWRUDTYZVQMG-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(c1ccc(cc1)C)([N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.095g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.287g/mol
Monoisotopic Mass:
286.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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