Chem
J-GLOBAL ID：200907013784891644
Nikkaji number：J921.004K
3-Phenyl-1,2-benzisoxazole
3-フェニル-1,2-ベンゾオキサゾール
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： C13H9NO
Molecular formula furigana： C13-H9-N-O
Molecular weight： 195.221
InChI：
InChI=1S/C13H9NO/c1-2-6-10(7-3-1)13-11-8-4-5-9-12(11)15-14-13/h1-9H
InChI key：
POCCWZYCZJRTQM-UHFFFAOYSA-N
SMILES：
c1ccc(cc1)c1noc2ccccc12
Systematic name (3)：
- 3-フェニル-1,2-ベンゾイソオキサゾール
- 3-フェニル-1,2-ベンゾオキサゾール
- 3-phenyl-1,2-benzoxazole
- 3-Phenyl-1,2-benzisoxazole
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