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933674-92-1 | 1,2,5-Trifluoro-4-methyl-3-trifluoromethyl-benzene
CAS No: 933674-92-1 Catalog No: AG01EZCR MDL No:
Product Description
Catalog Number:
AG01EZCR
Chemical Name:
1,2,5-Trifluoro-4-methyl-3-trifluoromethyl-benzene
CAS Number:
933674-92-1
Molecular Formula:
C8H4F6
Molecular Weight:
214.1078
IUPAC Name:
1,2,5-trifluoro-4-methyl-3-(trifluoromethyl)benzene
InChI:
InChI=1S/C8H4F6/c1-3-4(9)2-5(10)7(11)6(3)8(12,13)14/h2H,1H3
InChI Key:
IWIGNHXTXFRICW-UHFFFAOYSA-N
SMILES:
Fc1cc(F)c(c(c1C)C(F)(F)F)F
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.022g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.11g/mol
Monoisotopic Mass:
214.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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