Chem
J-GLOBAL ID:200907015274631411
Nikkaji number:J2.040.171K
3,5-Difluoro-4′′-butoxy-1,1′:4′,1′′-terbenzene-4-yl isothiocyanate
4'-(4-ブトキシフェニル)-3,5-ジフルオロ-4-イソチオシアナト-1,1'-ビフェニル
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Substance type:
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
Molecular formula:
C23 H19 F2 NOS
Molecular formula furigana:
C23-H19-F2-N-O-S
Molecular weight:
395.470
InChI:
InChI=1S/C23H19F2NOS/c1-2-3-12-27-20-10-8-17(9-11-20)16-4-6-18(7-5-16)19-13-21(24)23(26-15-28)22(25)14-19/h4-11,13-14H,2-3,12H2,1H3
InChI key:
UXZQIXKPDMKNNC-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(cc1)c1ccc(cc1)c1cc(F)c(N=C=S)c(F)c1
Systematic name (3):
3,5-ジフルオロ-4′′-ブトキシ-1,1′:4′,1′′-テルベンゼン-4-イルイソチオシアナート
4'-(4-ブトキシフェニル)-3,5-ジフルオロ-4-イソチオシアナト-1,1'-ビフェニル
4'-(4-butoxyphenyl)-3,5-difluoro-4-isothiocyanato-1,1'-biphenyl
Other name (1):
3,5-Difluoro-4′′-butoxy-1,1′:4′,1′′-terbenzene-4-yl isothiocyanate
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