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Home > Nitro Compounds > 811848-77-8
811848-77-8 | Diazene, bis(2,4-dimethyl-6-nitrophenyl)-, (1E)-
CAS No: 811848-77-8 Catalog No: AG004ZHG MDL No:
Product Description
Catalog Number:
AG004ZHG
Chemical Name:
Diazene, bis(2,4-dimethyl-6-nitrophenyl)-, (1E)-
CAS Number:
811848-77-8
Molecular Formula:
C16H16N4O4
Molecular Weight:
328.3226
IUPAC Name:
bis(2,4-dimethyl-6-nitrophenyl)diazene
InChI:
InChI=1S/C16H16N4O4/c1-9-5-11(3)15(13(7-9)19(21)22)17-18-16-12(4)6-10(2)8-14(16)20(23)24/h5-8H,1-4H3
InChI Key:
SLRAGGABEWYGLN-UHFFFAOYSA-N
SMILES:
Cc1cc(C)c(c(c1)[N+](=O)[O-])/N=N/c1c(C)cc(cc1[N+](=O)[O-])C
Properties
Complexity:
457
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.117g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
328.328g/mol
Monoisotopic Mass:
328.117g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
Literature
| Title | Journal |
|---|---|
| Trans-2,2',4,4'-tetramethyl-6,6'-dinitroazobenzene from Aconitum sungpanense. | Fitoterapia 20041201 |
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