Chem
J-GLOBAL ID：201707000045512668
Nikkaji number：J3.567.346F
1-(4-Fluorophenyl)(2-2H)ethyne
1-(4-フルオロフェニル)(2-2H)エチン
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： C8H4[2H]F
Molecular formula furigana： C8-H5-F
Molecular weight： 121.133
InChI：
InChI=1S/C8H5F/c1-2-7-3-5-8(9)6-4-7/h1,3-6H/i1D
InChI key：
QXSWHQGIEKUBAS-MICDWDOJSA-N
SMILES：
C(#Cc1ccc(F)cc1)[2H]
Systematic name (3)：
- 1-(4-フルオロフェニル)(2-2H)エチン
- 1-[(2-2H)エチニル]-4-フルオロベンゼン
- 1-[(2-2H)ethynyl]-4-fluorobenzene
- 1-(4-Fluorophenyl)(2-2H)ethyne
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