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Home > Fluorides > 1007455-25-5
1007455-25-5 | 1H-Isoindol-1-one, 5-fluoro-2,3-dihydro-6-hydroxy-
CAS No: 1007455-25-5 Catalog No: AG0002RK MDL No:
Product Description
Catalog Number:
AG0002RK
Chemical Name:
1H-Isoindol-1-one, 5-fluoro-2,3-dihydro-6-hydroxy-
CAS Number:
1007455-25-5
Molecular Formula:
C8H6FNO2
Molecular Weight:
167.1371
IUPAC Name:
5-fluoro-6-hydroxy-2,3-dihydroisoindol-1-one
InChI:
InChI=1S/C8H6FNO2/c9-6-1-4-3-10-8(12)5(4)2-7(6)11/h1-2,11H,3H2,(H,10,12)
InChI Key:
XDCZVYFOCSBMCW-UHFFFAOYSA-N
SMILES:
O=C1NCc2c1cc(O)c(c2)F
Properties
Complexity:
209
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.038g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
167.139g/mol
Monoisotopic Mass:
167.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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