Home Halogens 2-Pyridinecarboxaldehyde, 5-bromo-3-(trifluoromethyl)-

2-Pyridinecarboxaldehyde, 5-bromo-3-(trifluoromethyl)-

CAS No.:
1227489-83-9
Catalog Number:
AG000J8X
Molecular Formula:
C7H3BrF3NO
Molecular Weight:
254.0040
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Product Description
Catalog Number:
AG000J8X
Chemical Name:
2-Pyridinecarboxaldehyde, 5-bromo-3-(trifluoromethyl)-
CAS Number:
1227489-83-9
Molecular Formula:
C7H3BrF3NO
Molecular Weight:
254.0040
MDL Number:
MFCD16606468
IUPAC Name:
5-bromo-3-(trifluoromethyl)pyridine-2-carbaldehyde
InChI:
InChI=1S/C7H3BrF3NO/c8-4-1-5(7(9,10)11)6(3-13)12-2-4/h1-3H
InChI Key:
ORYNYDHLVBQOAJ-UHFFFAOYSA-N
SMILES:
O=Cc1ncc(cc1C(F)(F)F)Br
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.935g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.006g/mol
Monoisotopic Mass:
252.935g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties