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Home > Nitro Compounds > 1465-51-6
1465-51-6 | Benzene, 1,1'-(diazomethylene)bis[3-nitro- (9CI)
CAS No: 1465-51-6 Catalog No: AG001E31 MDL No:
Product Description
Catalog Number:
AG001E31
Chemical Name:
Benzene, 1,1'-(diazomethylene)bis[3-nitro- (9CI)
CAS Number:
1465-51-6
Molecular Formula:
C13H8N4O4
Molecular Weight:
284.2270
IUPAC Name:
1-[diazo-(3-nitrophenyl)methyl]-3-nitrobenzene
InChI:
InChI=1S/C13H8N4O4/c14-15-13(9-3-1-5-11(7-9)16(18)19)10-4-2-6-12(8-10)17(20)21/h1-8H
InChI Key:
FVZLLACXHRQMTG-UHFFFAOYSA-N
SMILES:
[N-]=[N+]=C(c1cccc(c1)[N+](=O)[O-])c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.055g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.231g/mol
Monoisotopic Mass:
284.055g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
93.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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