Chem
J-GLOBAL ID：201007083664405150
Nikkaji number：J2.889.120B
7-Phenyl-6-heptyne-1,5-diol
7-フェニル-6-ヘプチン-1,5-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： C13H16O2
Molecular formula furigana： C13-H16-O2
Molecular weight： 204.269
InChI：
InChI=1S/C13H16O2/c14-11-5-4-8-13(15)10-9-12-6-2-1-3-7-12/h1-3,6-7,13-15H,4-5,8,11H2
InChI key：
UCGLMQGGRJZHKS-UHFFFAOYSA-N
SMILES：
OCCCCC(O)C#Cc1ccccc1
Systematic name (3)：
- 7-フェニル-6-ヘプチン-1,5-ジオール
- 7-フェニルヘプタ-6-イン-1,5-ジオール
- 7-phenylhept-6-yne-1,5-diol
- 7-Phenyl-6-heptyne-1,5-diol
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