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362-21-0 | 2-(Trifluoromethyl)anthraquinone
CAS No: 362-21-0 Catalog No: AG01EVPE MDL No:
Product Description
Catalog Number:
AG01EVPE
Chemical Name:
2-(Trifluoromethyl)anthraquinone
CAS Number:
362-21-0
Molecular Formula:
C15H7F3O2
Molecular Weight:
276.2101
IUPAC Name:
2-(trifluoromethyl)anthracene-9,10-dione
InChI:
InChI=1S/C15H7F3O2/c16-15(17,18)8-5-6-11-12(7-8)14(20)10-4-2-1-3-9(10)13(11)19/h1-7H
InChI Key:
WGDPBTLIVMMBGC-UHFFFAOYSA-N
SMILES:
O=C1c2cc(ccc2C(=O)c2c1cccc2)C(F)(F)F
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.04g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.214g/mol
Monoisotopic Mass:
276.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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