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1260666-80-5 | 1H-Isoindol-1-one, 5-fluoro-2,3-dihydro-
CAS No: 1260666-80-5 Catalog No: AG000R05 MDL No:MFCD18204658
Product Description
Catalog Number:
AG000R05
Chemical Name:
1H-Isoindol-1-one, 5-fluoro-2,3-dihydro-
CAS Number:
1260666-80-5
Molecular Formula:
C8H6FNO
Molecular Weight:
151.1377
MDL Number:
MFCD18204658
IUPAC Name:
5-fluoro-2,3-dihydroisoindol-1-one
InChI:
InChI=1S/C8H6FNO/c9-6-1-2-7-5(3-6)4-10-8(7)11/h1-3H,4H2,(H,10,11)
InChI Key:
NKCDELXKANYEQE-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)CNC2=O
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.043g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.14g/mol
Monoisotopic Mass:
151.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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