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Home > Fluorides > 1027513-14-9
1027513-14-9 | Benzene, 1-fluoro-3-iodo-5-(trifluoromethyl)-
CAS No: 1027513-14-9 Catalog No: AG0008A3 MDL No:MFCD09800718
Product Description
Catalog Number:
AG0008A3
Chemical Name:
Benzene, 1-fluoro-3-iodo-5-(trifluoromethyl)-
CAS Number:
1027513-14-9
Molecular Formula:
C7H3F4I
Molecular Weight:
289.9968
MDL Number:
MFCD09800718
IUPAC Name:
1-fluoro-3-iodo-5-(trifluoromethyl)benzene
InChI:
InChI=1S/C7H3F4I/c8-5-1-4(7(9,10)11)2-6(12)3-5/h1-3H
InChI Key:
WSIULLRVUJJWOW-UHFFFAOYSA-N
SMILES:
Fc1cc(I)cc(c1)C(F)(F)F
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.922g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.999g/mol
Monoisotopic Mass:
289.922g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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