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Home > Fluorides > 156301-66-5
156301-66-5 | Anthracene, 9,10-bis[2-[4-(trifluoromethyl)phenyl]ethynyl]-
CAS No: 156301-66-5 Catalog No: AG001ONQ MDL No:
Product Description
Catalog Number:
AG001ONQ
Chemical Name:
Anthracene, 9,10-bis[2-[4-(trifluoromethyl)phenyl]ethynyl]-
CAS Number:
156301-66-5
Molecular Formula:
C32H16F6
Molecular Weight:
514.4599
IUPAC Name:
9,10-bis[2-[4-(trifluoromethyl)phenyl]ethynyl]anthracene
InChI:
InChI=1S/C32H16F6/c33-31(34,35)23-15-9-21(10-16-23)13-19-29-25-5-1-2-6-26(25)30(28-8-4-3-7-27(28)29)20-14-22-11-17-24(18-12-22)32(36,37)38/h1-12,15-18H
InChI Key:
GMZYKAVEXOFFPV-UHFFFAOYSA-N
SMILES:
FC(c1ccc(cc1)C#Cc1c2ccccc2c(c2c1cccc2)C#Cc1ccc(cc1)C(F)(F)F)(F)F
Properties
Complexity:
832
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
514.116g/mol
Formal Charge:
0
Heavy Atom Count:
38
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
514.47g/mol
Monoisotopic Mass:
514.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.2
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