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Home > Bromides > 1227502-50-2
1227502-50-2 | Pyridine, 2-(bromomethyl)-3-chloro-5-(trifluoromethyl)-
CAS No: 1227502-50-2 Catalog No: AG000J9X MDL No:MFCD16607521
Product Description
Catalog Number:
AG000J9X
Chemical Name:
Pyridine, 2-(bromomethyl)-3-chloro-5-(trifluoromethyl)-
CAS Number:
1227502-50-2
Molecular Formula:
C7H4BrClF3N
Molecular Weight:
274.4656
MDL Number:
MFCD16607521
IUPAC Name:
2-(bromomethyl)-3-chloro-5-(trifluoromethyl)pyridine
InChI:
InChI=1S/C7H4BrClF3N/c8-2-6-5(9)1-4(3-13-6)7(10,11)12/h1,3H,2H2
InChI Key:
WPALGCBMYXXOSU-UHFFFAOYSA-N
SMILES:
BrCc1ncc(cc1Cl)C(F)(F)F
Properties
Complexity:
176
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.917g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.465g/mol
Monoisotopic Mass:
272.917g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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