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1196151-51-5 | 2-Pyrimidinecarboxylic acid, 5-fluoro-
CAS No: 1196151-51-5 Catalog No: AG000PAJ MDL No:MFCD13189599
Product Description
Catalog Number:
AG000PAJ
Chemical Name:
2-Pyrimidinecarboxylic acid, 5-fluoro-
CAS Number:
1196151-51-5
Molecular Formula:
C5H3FN2O2
Molecular Weight:
142.0879
MDL Number:
MFCD13189599
IUPAC Name:
5-fluoropyrimidine-2-carboxylic acid
InChI:
InChI=1S/C5H3FN2O2/c6-3-1-7-4(5(9)10)8-2-3/h1-2H,(H,9,10)
InChI Key:
BRHVWYOCJKRZBG-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncc(cn1)F
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.018g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
142.089g/mol
Monoisotopic Mass:
142.018g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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