Chem
J-GLOBAL ID:200907017979212526   Nikkaji number:J965.902A

(5S,6R,9S)-5-Chloro-6,9-dibromo-1,2,3,3a,4,5,6,7,8,8a-decahydro-2,5-cyclo-1,7:4,8-dimethanoazulene

(4S,9S,10R)-4,10-ジブロモ-9-クロロペンタシクロ[6.4.0.02,6.03,11.05,9]ドデカン
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: C12H13Br2Cl
Molecular formula furigana: C12-H13-BR2-CL
Molecular weight: 352.490
InChI: InChI=1S/C12H13Br2Cl/c13-10-8-5-1-3-6-2-4(7(3)8)9(10)12(6,15)11(5)14/h3-11H,1-2H2/t3?,4?,5?,6?,7?,8?,9?,10-,11+,12-/m0/s1
InChI key: KJSZJEOSXBGENP-LRPRZMQISA-N
SMILES: Cl[C@@]12C3CC4C5C3CC(C5[C@H](Br)C14)[C@H]2Br
Systematic name  (3):
  • (5S,6R,9S)-5-クロロ-6,9-ジブロモ-1,2,3,3a,4,5,6,7,8,8a-デカヒドロ-2,5-シクロ-1,7:4,8-ジメタノアズレン
  • (4S,9S,10R)-4,10-ジブロモ-9-クロロペンタシクロ[6.4.0.02,6.03,11.05,9]ドデカン
  • (4S,9S,10R)-4,10-dibromo-9-chloropentacyclo[6.4.0.02,6.03,11.05,9]dodecane
Other name (1):
  • (5S,6R,9S)-5-Chloro-6,9-dibromo-1,2,3,3a,4,5,6,7,8,8a-decahydro-2,5-cyclo-1,7:4,8-dimethanoazulene
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