Chem
J-GLOBAL ID：201207020339179316
Nikkaji number：J3.092.077E
4-Dodecyl-4′-isothiocyanato-1,1′-biphenyl
4-ドデシル-4′-イソチオシアナト-1,1′-ビフェニル
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： C25H33NS
Molecular formula furigana： C25-H33-N-S
Molecular weight： 379.610
InChI：
InChI=1S/C25H33NS/c1-2-3-4-5-6-7-8-9-10-11-12-22-13-15-23(16-14-22)24-17-19-25(20-18-24)26-21-27/h13-20H,2-12H2,1H3
InChI key：
DFBFADVDKIEWQX-UHFFFAOYSA-N
SMILES：
CCCCCCCCCCCCc1ccc(cc1)c1ccc(cc1)N=C=S
Systematic name (4)：
- 4-ドデシル-4′-イソチオシアナト-1,1′-ビフェニル
- 4′-ドデシル-1,1′-ビフェニル-4-イルイソチオシアナート
- 4-ドデシル-4'-イソチオシアナト-1,1'-ビフェニル
- 4-dodecyl-4'-isothiocyanato-1,1'-biphenyl
- 4-Dodecyl-4′-isothiocyanato-1,1′-biphenyl
- 4′-Dodecyl-1,1′-biphenyl-4-yl isothiocyanate
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