Chem
J-GLOBAL ID:200907014326929531   Nikkaji number:J2.078.075D

Tris[(1-tert-butyl-2-mercapto-1H-imidazole-3-ium)-3-yl] boronanion

トリス[(1-tert-ブチル-2-メルカプト-1H-イミダゾール-3-イウム)-3-イル]ほう素アニオン
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: C21H37[B-]N3[N+]3S3
Molecular formula furigana: C21-H37-B-N6-S3
Molecular weight: 480.560
InChI: InChI=1S/C21H34BN6S3/c1-19(2,3)23-10-13-26(16(23)29)22(27-14-11-24(17(27)30)20(4,5)6)28-15-12-25(18(28)31)21(7,8)9/h10-15,22H,1-9H3/q-1/p+3
InChI key: WXNWDHUZSCMSHV-UHFFFAOYSA-Q
SMILES: CC(C)(C)[n+]1ccn([B-](n2cc[n+](c2S)C(C)(C)C)n2cc[n+](c2S)C(C)(C)C)c1S
Systematic name  (3):
  • トリス[(3-tert-ブチル-2-メルカプト-1H-イミダゾール-3-イウム)-1-イル]ほう素アニオン
  • トリス[(2-メルカプト-3-tert-ブチル-1H-イミダゾール-3-イウム)-1-イル]ほう素アニオン
  • トリス[(1-tert-ブチル-2-メルカプト-1H-イミダゾール-3-イウム)-3-イル]ほう素アニオン
Other name (3):
  • Tris[(3-tert-butyl-2-mercapto-1H-imidazole-3-ium)-1-yl] boronanion
  • Tris[(2-mercapto-3-tert-butyl-1H-imidazole-3-ium)-1-yl] boronanion
  • Tris[(1-tert-butyl-2-mercapto-1H-imidazole-3-ium)-3-yl] boronanion
Thsaurus map:

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