Chem
J-GLOBAL ID：201007062420483496   Nikkaji number：J2.833.819H

2,3-Diphenyl-1-titana(IV)cyclopentane-2-ene-5-carboxylic acid tert-butyl ester

tert-ブチル 4,5-ジフェニル-1-チタナシクロペンタ-4-エン-2-カルボキシラート
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： C21H22O2Ti
Molecular formula furigana： C21-H22-O2-TI
Molecular weight： 354.272
InChI： InChI=1S/C21H22O2.Ti/c1-21(2,3)23-20(22)15-14-19(18-12-8-5-9-13-18)16-17-10-6-4-7-11-17;/h4-13,15H,14H2,1-3H3;
InChI key： IBPOQWUGNXEELB-UHFFFAOYSA-N
SMILES： CC(C)(C)OC(=O)C1CC(=C([Ti]1)c1ccccc1)c1ccccc1
Systematic name  (3)：
  • 2,3-ジフェニル-1-チタナ(IV)シクロペンタン-2-エン-5-カルボン酸tert-ブチル
  • tert-ブチル 4,5-ジフェニル-1-チタナシクロペンタ-4-エン-2-カルボキシラート
  • tert-butyl 4,5-diphenyl-1-titanacyclopent-4-ene-2-carboxylate
Other name (1)：
  • 2,3-Diphenyl-1-titana(IV)cyclopentane-2-ene-5-carboxylic acid tert-butyl ester
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