Chem
J-GLOBAL ID：200907053954740052   Nikkaji number：J547.051J

Monochlorobimane

モノクロロビマン
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： C10H11ClN2O2
Molecular formula furigana： C10-H11-CL-N2-O2
Molecular weight： 226.660
InChI： InChI=1S/C10H11ClN2O2/c1-5-7(3)12-8(4-11)6(2)10(15)13(12)9(5)14/h4H2,1-3H3
InChI key： SUIPVTCEECPFIB-UHFFFAOYSA-N
SMILES： Cc1c(C)c(=O)n2n1c(CCl)c(C)c2=O
Systematic name  (3)：
  • 3-(クロロメチル)-2,5,6-トリメチル-1H,7H-ピラゾロ[1,2-a]ピラゾール-1,7-ジオン
  • 3-(クロロメチル)-2,5,6-トリメチル-1H,7H-[1,2]ジアゾロ[1,2-a]ピラゾール-1,7-ジオン
  • 3-(chloromethyl)-2,5,6-trimethyl-1H,7H-[1,2]diazolo[1,2-a]pyrazole-1,7-dione
Other name (6)：
  • モノクロロビマン
  • Monochlorobimane
  • 3-(Chloromethyl)-2,5,6-trimethyl-1H,7H-pyrazolo[1,2-a]pyrazole-1,7-dione
  • NSC-602733
  • チオライトMC
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CAS registry number： 76421-73-3
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