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Home > Fluorides > 287172-66-1
287172-66-1 | Benzene, 1,1'-(1,2-ethanediyl)bis[2-(trifluoromethyl)-
CAS No: 287172-66-1 Catalog No: AG002W8N MDL No:
Product Description
Catalog Number:
AG002W8N
Chemical Name:
Benzene, 1,1'-(1,2-ethanediyl)bis[2-(trifluoromethyl)-
CAS Number:
287172-66-1
Molecular Formula:
C16H12F6
Molecular Weight:
318.2569
IUPAC Name:
1-(trifluoromethyl)-2-[2-[2-(trifluoromethyl)phenyl]ethyl]benzene
InChI:
InChI=1S/C16H12F6/c17-15(18,19)13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)16(20,21)22/h1-8H,9-10H2
InChI Key:
OBMDBKNYJGWWJX-UHFFFAOYSA-N
SMILES:
FC(c1ccccc1CCc1ccccc1C(F)(F)F)(F)F
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.084g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.262g/mol
Monoisotopic Mass:
318.084g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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