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Home > Bromides > 1227574-31-3
1227574-31-3 | Pyridine, 3-(bromomethyl)-5-(trifluoromethyl)-
CAS No: 1227574-31-3 Catalog No: AG000JB2 MDL No:
Product Description
Catalog Number:
AG000JB2
Chemical Name:
Pyridine, 3-(bromomethyl)-5-(trifluoromethyl)-
CAS Number:
1227574-31-3
Molecular Formula:
C7H5BrF3N
Molecular Weight:
240.0205
IUPAC Name:
3-(bromomethyl)-5-(trifluoromethyl)pyridine
InChI:
InChI=1S/C7H5BrF3N/c8-2-5-1-6(4-12-3-5)7(9,10)11/h1,3-4H,2H2
InChI Key:
HXNJVBBHAGFQEL-UHFFFAOYSA-N
SMILES:
BrCc1cncc(c1)C(F)(F)F
Properties
Complexity:
148
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.956g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.023g/mol
Monoisotopic Mass:
238.956g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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