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Home > Bromides > 1052714-46-1
1052714-46-1 | 6-Bromo-5-Fluoro-2-Pyridinecarboxylic Acid
CAS No: 1052714-46-1 Catalog No: AG0034CD MDL No:MFCD13185797
Product Description
Catalog Number:
AG0034CD
Chemical Name:
6-Bromo-5-Fluoro-2-Pyridinecarboxylic Acid
CAS Number:
1052714-46-1
Molecular Formula:
C6H3BrFNO2
Molecular Weight:
219.9959
MDL Number:
MFCD13185797
IUPAC Name:
6-bromo-5-fluoropyridine-2-carboxylic acid
InChI:
InChI=1S/C6H3BrFNO2/c7-5-3(8)1-2-4(9-5)6(10)11/h1-2H,(H,10,11)
InChI Key:
UVDJYBXHNFJTME-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(n1)Br)F
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.933g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
219.997g/mol
Monoisotopic Mass:
218.933g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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