Chem
J-GLOBAL ID：200907076200404579   Nikkaji number：J80.531I

4,4'-Azobis(4-cyanopentanoic acid)

4,4′-アゾビス(4-シアノペンタン酸)
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C12H16N4O4
Molecular formula furigana： C12-H16-N4-O4
Molecular weight： 280.284
InChI： InChI=1S/C12H16N4O4/c1-11(7-13,5-3-9(17)18)15-16-12(2,8-14)6-4-10(19)20/h3-6H2,1-2H3,(H,17,18)(H,19,20)
InChI key： VFXXTYGQYWRHJP-UHFFFAOYSA-N
SMILES： CC(CCC(=O)O)(N=NC(C)(CCC(=O)O)C#N)C#N
Systematic name  (8)：
  • 4,4′-アゾビス(4-シアノ吉草酸)
  • 4,4′-アゾビス(4-シアノペンタン酸)
  • 4,4′-アジビス(4-シアノペンタン酸)
  • 4,4′-アゾビス(4-シアノ-4-メチル-ブタン酸)
  • 4,4′-(ジアゼン-1,2-ジイル)ビス(4-シアノペンタン酸)
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Other name (8)：
  • 4,4′-Azobis(4-cyanopentanoic acid)
  • 4,4′-Azobis(4-cyanovaleric acid)
  • 4,4′-Azibis(4-cyanopentanoic acid)
  • 4,4′-Azobis(4-cyano-4-methyl-butanoic acid)
  • 4,4′-(Diazene-1,2-diyl)bis(4-cyanopentanoic acid)
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CAS registry number： 2638-94-0
Regulation number (3)：
  • EINECS2201350
  • TSCA(2638-94-0)
  • (2)-2794
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