Home Halogens methyl 6-bromo-2-(trifluoromethyl)pyridine-3-carboxylate

methyl 6-bromo-2-(trifluoromethyl)pyridine-3-carboxylate

CAS No.:
1227581-53-4
Catalog Number:
AG01DYJE
Molecular Formula:
C8H5BrF3NO2
Molecular Weight:
284.0300
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Product Description
Catalog Number:
AG01DYJE
Chemical Name:
methyl 6-bromo-2-(trifluoromethyl)pyridine-3-carboxylate
CAS Number:
1227581-53-4
Molecular Formula:
C8H5BrF3NO2
Molecular Weight:
284.0300
MDL Number:
MFCD16611600
IUPAC Name:
methyl 6-bromo-2-(trifluoromethyl)pyridine-3-carboxylate
InChI:
InChI=1S/C8H5BrF3NO2/c1-15-7(14)4-2-3-5(9)13-6(4)8(10,11)12/h2-3H,1H3
InChI Key:
CLDWYJSYLHPUHV-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(nc1C(F)(F)F)Br
Properties
Complexity:
247  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.946g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.032g/mol
Monoisotopic Mass:
282.946g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties