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Home > Aldehydes > 741737-02-0
741737-02-0 | 4-Pyridinecarboxaldehyde,3,5-dibromo-2-methoxy-6-(trifluoromethyl)-
CAS No: 741737-02-0 Catalog No: AG005NM8 MDL No:
Product Description
Catalog Number:
AG005NM8
Chemical Name:
4-Pyridinecarboxaldehyde,3,5-dibromo-2-methoxy-6-(trifluoromethyl)-
CAS Number:
741737-02-0
Molecular Formula:
C8H4Br2F3NO2
Molecular Weight:
362.9261
IUPAC Name:
3,5-dibromo-2-methoxy-6-(trifluoromethyl)pyridine-4-carbaldehyde
InChI:
InChI=1S/C8H4Br2F3NO2/c1-16-7-5(10)3(2-15)4(9)6(14-7)8(11,12)13/h2H,1H3
InChI Key:
YFDFZJVJLCWFGH-UHFFFAOYSA-N
SMILES:
COc1nc(c(c(c1Br)C=O)Br)C(F)(F)F
Properties
Complexity:
264
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
362.854g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
362.928g/mol
Monoisotopic Mass:
360.856g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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