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Home > Nitro Compounds > 24239-79-0
24239-79-0 | Benzene,1,4-bis(dinitromethyl)-
CAS No: 24239-79-0 Catalog No: AG006WR8 MDL No:
Product Description
Catalog Number:
AG006WR8
Chemical Name:
Benzene,1,4-bis(dinitromethyl)-
CAS Number:
24239-79-0
Molecular Formula:
C8H6N4O8
Molecular Weight:
286.1552
IUPAC Name:
1,4-bis(dinitromethyl)benzene
InChI:
InChI=1S/C8H6N4O8/c13-9(14)7(10(15)16)5-1-2-6(4-3-5)8(11(17)18)12(19)20/h1-4,7-8H
InChI Key:
KMRRAUKINNGJAR-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)C(c1ccc(cc1)C([N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
342
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.019g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.156g/mol
Monoisotopic Mass:
286.019g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
183A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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