Chem
J-GLOBAL ID：200907015020691740
Nikkaji number：J1.688.923G
(3S)-3α,5β-Di-tert-butyl-4-zirconacyclopenta-1-yne
(3S)-3α,5β-ジ-tert-ブチル-4-ジルコナシクロペンタ-1-イン
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
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
Molecular formula： C12H20Zr
Molecular formula furigana： C12-H20-ZR
Molecular weight： 255.516
InChI：
InChI=1S/C12H20.Zr/c1-11(2,3)9-7-8-10-12(4,5)6;/h9-10H,1-6H3;
InChI key：
SKXBZKBYYSYZCF-UHFFFAOYSA-N
SMILES：
CC(C)(C)[C@@H]1[Zr][C@H](C#C1)C(C)(C)C
Systematic name (3)：
- (3S)-3α,5β-ジ-tert-ブチル-4-ジルコナシクロペンタ-1-イン
- (2S,5S)-2,5-ジ-tert-ブチル-1-ジルコナシクロペンタ-3-イン
- (2S,5S)-2,5-di-tert-butyl-1-zirconacyclopent-3-yne
- (3S)-3α,5β-Di-tert-butyl-4-zirconacyclopenta-1-yne
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