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1057395-84-2 | 2-(5-Fluoropyridin-2-yl)-2-methylpropanoic acid
CAS No: 1057395-84-2 Catalog No: AG01F9PG MDL No:
Product Description
Catalog Number:
AG01F9PG
Chemical Name:
2-(5-Fluoropyridin-2-yl)-2-methylpropanoic acid
CAS Number:
1057395-84-2
Molecular Formula:
C9H10FNO2
Molecular Weight:
183.1796
IUPAC Name:
2-(5-fluoropyridin-2-yl)-2-methylpropanoic acid
InChI:
InChI=1S/C9H10FNO2/c1-9(2,8(12)13)7-4-3-6(10)5-11-7/h3-5H,1-2H3,(H,12,13)
InChI Key:
NZFBVVOJAZULAR-UHFFFAOYSA-N
SMILES:
Fc1ccc(nc1)C(C(=O)O)(C)C
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.07g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
183.182g/mol
Monoisotopic Mass:
183.07g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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