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Home > Fluorides > 1823644-43-4
1823644-43-4 | 1-(2,2,2-Trifluoroethyl)-3-(trifluoromethoxy)-benzene
CAS No: 1823644-43-4 Catalog No: AG01EUF9 MDL No:MFCD28166239
Product Description
Catalog Number:
AG01EUF9
Chemical Name:
1-(2,2,2-Trifluoroethyl)-3-(trifluoromethoxy)-benzene
CAS Number:
1823644-43-4
Molecular Formula:
C9H6F6O
Molecular Weight:
244.1338
MDL Number:
MFCD28166239
IUPAC Name:
1-(2,2,2-trifluoroethyl)-3-(trifluoromethoxy)benzene
InChI:
InChI=1S/C9H6F6O/c10-8(11,12)5-6-2-1-3-7(4-6)16-9(13,14)15/h1-4H,5H2
InChI Key:
GAXOIYNVXZXCKX-UHFFFAOYSA-N
SMILES:
FC(Cc1cccc(c1)OC(F)(F)F)(F)F
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.032g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.136g/mol
Monoisotopic Mass:
244.032g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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