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Anthracene-2,6-diyl Bis(trifluoromethanesulfonate)

Catalog Number
ACM594838616
CAS Number
594838-61-6
Product Name
Anthracene-2,6-diyl Bis(trifluoromethanesulfonate)
Category
Small Molecule Semiconductor Building Blocks; Semiconductor Blocks
IUPAC Name
[6-(trifluoromethylsulfonyloxy)anthracen-2-yl] trifluoromethanesulfonate
Molecular Weight
474.4g/mol
Molecular Formula
C16H8F6O6S2
Canonical SMILES
C1=CC(=CC2=CC3=C(C=C21)C=C(C=C3)OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F
InChI
InChI=1S/C16H8F6O6S2/c17-15(18,19)29(23,24)27-13-3-1-9-5-12-8-14(28-30(25,26)16(20,21)22)4-2-10(12)6-11(9)7-13/h1-8H
InChI Key
ZGOORSQUXBKABZ-UHFFFAOYSA-N
Complexity
756
Covalently-Bonded Unit Count
1
Exact Mass
473.966649g/mol
Formal Charge
0
Heavy Atom Count
30
Monoisotopic Mass
473.966649g/mol
Rotatable Bond Count
4
XLogP3
5.9
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