Chem
J-GLOBAL ID:200907097072626323
Nikkaji number:J2.040.166D
2,6-Difluoro-4-[[4-(propylthio)phenyl]ethynyl]phenyl isothiocyanate
2,6-ジフルオロ-4-[[4-(プロピルチオ)フェニル]エチニル]フェニルイソチオシアナート
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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:
C18 H13 F2 NS2
Molecular formula furigana:
C18-H13-F2-N-S2
Molecular weight:
345.430
InChI:
InChI=1S/C18H13F2NS2/c1-2-9-23-15-7-5-13(6-8-15)3-4-14-10-16(19)18(21-12-22)17(20)11-14/h5-8,10-11H,2,9H2,1H3
InChI key:
FEWSUVGSSPLMCK-UHFFFAOYSA-N
SMILES:
CCCSc1ccc(cc1)C#Cc1cc(F)c(N=C=S)c(F)c1
Systematic name (3):
2,6-ジフルオロ-4-[[4-(プロピルチオ)フェニル]エチニル]フェニルイソチオシアナート
1,3-ジフルオロ-2-イソチオシアナト-5-{2-[4-(プロピルスルファニル)フェニル]エチニル}ベンゼン
1,3-difluoro-2-isothiocyanato-5-{2-[4-(propylsulfanyl)phenyl]ethynyl}benzene
Other name (1):
2,6-Difluoro-4-[[4-(propylthio)phenyl]ethynyl]phenyl isothiocyanate
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