Chem
J-GLOBAL ID：201607019667192925
Nikkaji number：J3.476.319D
5-Phenyl-4-pentyne-1,3-diol
5-フェニル-4-ペンチン-1,3-ジオール
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： C11H12O2
Molecular formula furigana： C11-H12-O2
Molecular weight： 176.215
InChI：
InChI=1S/C11H12O2/c12-9-8-11(13)7-6-10-4-2-1-3-5-10/h1-5,11-13H,8-9H2
InChI key：
JODPRNWUDPJUHR-UHFFFAOYSA-N
SMILES：
OCCC(O)C#Cc1ccccc1
Systematic name (3)：
- 5-フェニル-4-ペンチン-1,3-ジオール
- 5-フェニルペンタ-4-イン-1,3-ジオール
- 5-phenylpent-4-yne-1,3-diol
- 5-Phenyl-4-pentyne-1,3-diol
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