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Home > Nitro Compounds > 29418-58-4
29418-58-4 | Diazene, (4-methylphenyl)(4-nitrophenyl)- (9CI)
CAS No: 29418-58-4 Catalog No: AG002YBA MDL No:
Product Description
Catalog Number:
AG002YBA
Chemical Name:
Diazene, (4-methylphenyl)(4-nitrophenyl)- (9CI)
CAS Number:
29418-58-4
Molecular Formula:
C13H11N3O2
Molecular Weight:
241.2453
IUPAC Name:
(4-methylphenyl)-(4-nitrophenyl)diazene
InChI:
InChI=1S/C13H11N3O2/c1-10-2-4-11(5-3-10)14-15-12-6-8-13(9-7-12)16(17)18/h2-9H,1H3
InChI Key:
ILLZCQXUVXWGJA-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)N=Nc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.085g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.25g/mol
Monoisotopic Mass:
241.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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