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Home > Bromides > 1447953-13-0
1447953-13-0 | Quinoline, 3-bromo-6-(trifluoromethyl)-
CAS No: 1447953-13-0 Catalog No: AG001K6F MDL No:
Product Description
Catalog Number:
AG001K6F
Chemical Name:
Quinoline, 3-bromo-6-(trifluoromethyl)-
CAS Number:
1447953-13-0
Molecular Formula:
C10H5BrF3N
Molecular Weight:
276.0526
IUPAC Name:
3-bromo-6-(trifluoromethyl)quinoline
InChI:
InChI=1S/C10H5BrF3N/c11-8-4-6-3-7(10(12,13)14)1-2-9(6)15-5-8/h1-5H
InChI Key:
OEZOCEOAPZRERJ-UHFFFAOYSA-N
SMILES:
Brc1cnc2c(c1)cc(cc2)C(F)(F)F
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.956g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.056g/mol
Monoisotopic Mass:
274.956g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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