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Home > Bromides > 1215073-37-2
1215073-37-2 | Pyridine, 5-bromo-2-[3-(trifluoromethyl)phenyl]-
CAS No: 1215073-37-2 Catalog No: AG001547 MDL No:
Product Description
Catalog Number:
AG001547
Chemical Name:
Pyridine, 5-bromo-2-[3-(trifluoromethyl)phenyl]-
CAS Number:
1215073-37-2
Molecular Formula:
C12H7BrF3N
Molecular Weight:
302.0899
IUPAC Name:
5-bromo-2-[3-(trifluoromethyl)phenyl]pyridine
InChI:
InChI=1S/C12H7BrF3N/c13-10-4-5-11(17-7-10)8-2-1-3-9(6-8)12(14,15)16/h1-7H
InChI Key:
MMQGMAGVZIROCJ-UHFFFAOYSA-N
SMILES:
Brc1ccc(nc1)c1cccc(c1)C(F)(F)F
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300.971g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.094g/mol
Monoisotopic Mass:
300.971g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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