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1256945-00-2 | Benzene, 4-bromo-2-iodo-1-(trifluoromethyl)-
CAS No: 1256945-00-2 Catalog No: AG000OH8 MDL No:MFCD21603817
Product Description
Catalog Number:
AG000OH8
Chemical Name:
Benzene, 4-bromo-2-iodo-1-(trifluoromethyl)-
CAS Number:
1256945-00-2
Molecular Formula:
C7H3BrF3I
Molecular Weight:
350.9024
MDL Number:
MFCD21603817
IUPAC Name:
4-bromo-2-iodo-1-(trifluoromethyl)benzene
InChI:
InChI=1S/C7H3BrF3I/c8-4-1-2-5(6(12)3-4)7(9,10)11/h1-3H
InChI Key:
PGFPLTAEOHMUKY-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)I)C(F)(F)F
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.841g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
350.905g/mol
Monoisotopic Mass:
349.841g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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