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Home > Indoles and Oxindole > 659737-57-2
659737-57-2 | 6-Hydroxyisoindolin-1-one
CAS No: 659737-57-2 Catalog No: AG003N8Q MDL No:MFCD08276013
Product Description
Catalog Number:
AG003N8Q
Chemical Name:
6-Hydroxyisoindolin-1-one
CAS Number:
659737-57-2
Molecular Formula:
C8H5NO2
Molecular Weight:
147.1308
MDL Number:
MFCD08276013
IUPAC Name:
6-hydroxy-2,3-dihydroisoindol-1-one
InChI:
InChI=1S/C8H7NO2/c10-6-2-1-5-4-9-8(11)7(5)3-6/h1-3,10H,4H2,(H,9,11)
InChI Key:
YGEDYDDFFVHFEA-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)C(=O)N=C2
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.048g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
149.149g/mol
Monoisotopic Mass:
149.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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