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CAS 22617-04-5: 2-[2-(4-Chloro-2-nitrophenyl)diazenyl]-6-(1,1-dimethylethyl)-4-methylphenol

Formula:C17H18ClN3O3
InChI:InChI=1S/C17H18ClN3O3/c1-10-7-12(17(2,3)4)16(22)14(8-10)20-19-13-6-5-11(18)9-15(13)21(23)24/h5-9,22H,1-4H3
InChI key:InChIKey=VCXHQNDCECCAOQ-UHFFFAOYSA-N
SMILES:N(=NC1=C(O)C(C(C)(C)C)=CC(C)=C1)C2=C(N(=O)=O)C=C(Cl)C=C2
Synonyms:
  • (6E)-2-tert-butyl-6-[2-(4-chloro-2-nitrophenyl)hydrazinylidene]-4-methylcyclohexa-2,4-dien-1-one
  • 2'-Nitro-4'-chloro-2-hydroxy-3-tert-butyl-5-methylazobenzene
  • 2-[2-(4-Chloro-2-nitrophenyl)diazenyl]-6-(1,1-dimethylethyl)-4-methylphenol
  • Phenol, 2-((4-chloro-2-nitrophenyl)azo)-6-(1,1-dimethylethyl)-4-methyl-
  • Phenol, 2-(2-(4-chloro-2-nitrophenyl)diazenyl)-6-(1,1-dimethylethyl)-4-methyl-
  • p-Cresol, 2-tert-butyl-6-[(4-chloro-2-nitrophenyl)azo]-
  • 6-tert-Butyl-2-((4-chloro-2-nitrophenyl)azo)-p-cresol
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Found 1 products.
  • 6-tert-Butyl-4-methyl-2-((4-chloro-2-nitrophenyl)azo)phenol

    CAS:
    The 6-tert-butyl-4-methyl-2-(4-chloro-2-nitrophenyl) azo phenol (CAS: 126633-00-1) is a benzene with the nitro group in the para position. The electron delocalization of this molecule has been calculated to be 0.30, which is higher than that of benzene; this is due to the nitro group and the electron acceptor sites. This molecule also has a dihedral angle of 36 degrees, which means that it can rotate freely about its central axis. The benzene ring is not planar and contains two different types of bonds: donor atoms are represented by hydrogen bonds and acceptor atoms are represented by the bond with the nitro group.
    Formula:C17H18ClN3O3
    Purity:Min. 95%
    Molecular weight:347.8 g/mol

    Ref: 3D-FB150353

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