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Home > Fluorides > 1190319-98-2
1190319-98-2 | 2H-Indol-2-one, 5-fluoro-1,3-dihydro-3-hydroxy-3-methyl-
CAS No: 1190319-98-2 Catalog No: AG000HW1 MDL No:
Product Description
Catalog Number:
AG000HW1
Chemical Name:
2H-Indol-2-one, 5-fluoro-1,3-dihydro-3-hydroxy-3-methyl-
CAS Number:
1190319-98-2
Molecular Formula:
C9H8FNO2
Molecular Weight:
181.1637
IUPAC Name:
5-fluoro-3-hydroxy-3-methyl-1H-indol-2-one
InChI:
InChI=1S/C9H8FNO2/c1-9(13)6-4-5(10)2-3-7(6)11-8(9)12/h2-4,13H,1H3,(H,11,12)
InChI Key:
RUIXZWIBCQQCPH-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)C(C)(O)C(=O)N2
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.054g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
181.166g/mol
Monoisotopic Mass:
181.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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