AG003N8Q

659737-57-2 | 6-hydroxyisoindolin-1-one

AG003N8Q

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CAS Number	659737-57-2
Catalog Number	AG003N8Q(AGN-PC-00AXX4)
Chemical Name	6-hydroxyisoindolin-1-one
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
MDL Number	MFCD08276013
Molecular Formula	C8H7NO2
Molecular Weight	149.1467
SMILES	O=C1NCC2=C1C=C(O)C=C2
Synonyms	6-hydroxyisoindolin-1-one, 659737-57-2, 1H-Isoindol-1-one, 2,3-dihydro-6-hydroxy-, 6-hydroxy-2,3-dihydroisoindol-1-one, 6-HYDROXY-2,3-DIHYDRO-ISOINDOL-1-ONE, 6-HYDROXY-2,3-DIHYDRO-1H-ISOINDOL-1-ONE, 6-Hydroxyisoindoline-1-one, SCHEMBL4499446, CTK5C3313, DTXSID10468056, YGEDYDDFFVHFEA-UHFFFAOYSA-N, 0124AC, AM1124, ANW-64292, MFCD08276013, ZINC39059125, AKOS006287665, DS-4207, MB06080, MCULE-6029443180, AJ-97792, SC-70874, SC-70957, SY031207, 2,3-Dihydro-6-hydroxy-1H-isoindol-1-one, AB0081181, DB-073686, TC-153037, FT-0703206, MFCD08276013 (95%), L-1810, I10-0128, Z1824482581, C8H7NO2, CID11528364, AK103982, 1H-Isoindol-1-one, 2,3-dihydro-6-hydroxy- (9CI), 252061-66-8,

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

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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