Chem
J-GLOBAL ID：200907001376721210   Nikkaji number：J760.342H

Pivalic acid [(S)-6,7,8,9-tetrahydro-5H-benzocyclohepten]-5-yl ester

ピバル酸[(S)-6,7,8,9-テトラヒドロ-5H-ベンゾシクロヘプテン]-5-イル
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： C16H22O2
Molecular formula furigana： C16-H22-O2
Molecular weight： 246.350
InChI： InChI=1S/C16H22O2/c1-16(2,3)15(17)18-14-11-7-5-9-12-8-4-6-10-13(12)14/h4,6,8,10,14H,5,7,9,11H2,1-3H3/t14-/m0/s1
InChI key： UZOAKCZKBYBWTD-AWEZNQCLSA-N
SMILES： CC(C)(C)C(=O)O[C@H]1CCCCc2ccccc12
Systematic name  (3)：
  • ピバル酸[(S)-6,7,8,9-テトラヒドロ-5H-ベンゾシクロヘプテン]-5-イル
  • (5S)-6,7,8,9-テトラヒドロ-5H-ベンゾ[7]アンヌレン-5-イル 2,2-ジメチルプロパノアート
  • (5S)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl 2,2-dimethylpropanoate
Other name (1)：
  • Pivalic acid [(S)-6,7,8,9-tetrahydro-5H-benzocyclohepten]-5-yl ester
Thsaurus map：
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