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4-[Difluoro(3,4,5-trifluorophenoxy)methyl]-4'-ethyl-3,5-difluorobiphenyl
Catalog Number
ACM303186198
CAS
303186-19-8
IUPAC Name
2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-5-(4-ethylphenyl)-1,3-difluorobenzene
Molecular Weight
414.32
Molecular Formula
C21H13F7O
Product Information
Canonical SMILES
CCC1=CC=C(C=C1)C2=CC(=C(C(=C2)F)C(OC3=CC(=C(C(=C3)F)F)F)(F)F)F
InChI
InChI=1S/C21H13F7O/c1-2-11-3-5-12(6-4-11)13-7-15(22)19(16(23)8-13)21(27,28)29-14-9-17(24)20(26)18(25)10-14/h3-10H,2H2,1H3
InChI Key
ZTUBOAYBUBUTPH-UHFFFAOYSA-N
Melting Point
53 °C
Purity
>98.0%(GC)
Appearance
White to Almost white powder to crystal
Complexity
501
Exact Mass
414.085462g/mol
Heavy Atom Count
29
MDL Number
MFCD22376741
Monoisotopic Mass
414.085462g/mol
Reaxys Registry Number
11532701
Rotatable Bond Count
5
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