Chem
J-GLOBAL ID：200907068943146989
Nikkaji number：J19.367D
Benzyne
ベンザイン
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： C6H4
Molecular formula furigana： C6-H4
Molecular weight： 76.098
InChI：
InChI=1S/C6H4/c1-2-4-6-5-3-1/h1-4H
InChI key：
KLYCPFXDDDMZNQ-UHFFFAOYSA-N
SMILES：
C1=CC#CC=C1
Systematic name (3)：
- 1,2-ジデヒドロベンゼン
- 1,3-シクロヘキサジエン-5-イン
- 3,5-シクロヘキサジエン-1-イン
- ベンジン
- ベンザイン
- Benzyne
- 1,3-Cyclohexadien-5-yne
- o-Benzyne
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