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Home > Fluorides > 844885-10-5
844885-10-5 | 4-TERT-BUTYL-3',5'-DIFLUOROBENZOPHENONE
CAS No: 844885-10-5 Catalog No: AG004VR3 MDL No:
Product Description
Catalog Number:
AG004VR3
Chemical Name:
4-TERT-BUTYL-3',5'-DIFLUOROBENZOPHENONE
CAS Number:
844885-10-5
Molecular Formula:
C17H16F2O
Molecular Weight:
274.3051
IUPAC Name:
(4-tert-butylphenyl)-(3,5-difluorophenyl)methanone
InChI:
InChI=1S/C17H16F2O/c1-17(2,3)13-6-4-11(5-7-13)16(20)12-8-14(18)10-15(19)9-12/h4-10H,1-3H3
InChI Key:
GOVJMAJPDAHZEG-UHFFFAOYSA-N
SMILES:
O=C(c1cc(F)cc(c1)F)c1ccc(cc1)C(C)(C)C
Properties
Complexity:
329
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.117g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.311g/mol
Monoisotopic Mass:
274.117g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1
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