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2002-40-6 | Diazene, 1,2-bis[2-methyl-4-[2-(2-methylphenyl)diazenyl]phenyl]-
CAS No: 2002-40-6 Catalog No: AG002CM2 MDL No:
Product Description
Catalog Number:
AG002CM2
Chemical Name:
Diazene, 1,2-bis[2-methyl-4-[2-(2-methylphenyl)diazenyl]phenyl]-
CAS Number:
2002-40-6
Molecular Formula:
C28H26N6
Molecular Weight:
446.5462
IUPAC Name:
bis[2-methyl-4-[(2-methylphenyl)diazenyl]phenyl]diazene
InChI:
InChI=1S/C28H26N6/c1-19-9-5-7-11-25(19)31-29-23-13-15-27(21(3)17-23)33-34-28-16-14-24(18-22(28)4)30-32-26-12-8-6-10-20(26)2/h5-18H,1-4H3
InChI Key:
RPJGIKBNEOPHRN-UHFFFAOYSA-N
SMILES:
Cc1cc(ccc1N=Nc1ccc(cc1C)N=Nc1ccccc1C)N=Nc1ccccc1C
Properties
Complexity:
647
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
446.222g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
446.558g/mol
Monoisotopic Mass:
446.222g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
74.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8.7
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