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2-[(Trifluoromethyl)sulfinyl]-1,1'-biphenyl

Catalog Number
ACM129922492
CAS Number
129922-49-2
Product Name
2-[(Trifluoromethyl)sulfinyl]-1,1'-biphenyl
Structure
Category
Organic Light-Emitting Diode (OLED) Materials
IUPAC Name
1-phenyl-2-(trifluoromethylsulfinyl)benzene
Molecular Weight
270.27g/mol
Molecular Formula
C13H9F3OS
Canonical SMILES
C1=CC=C(C=C1)C2=CC=CC=C2S(=O)C(F)(F)F
InChI
InChI=1S/C13H9F3OS/c14-13(15,16)18(17)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H
InChI Key
CLDLXLKMMYJIEK-UHFFFAOYSA-N
Complexity
297
Covalently-Bonded Unit Count
1
Exact Mass
270.032621g/mol
Formal Charge
0
Heavy Atom Count
18
Monoisotopic Mass
270.032621g/mol
Rotatable Bond Count
2
XLogP3
3.8
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