AG006G3O

675109-30-5 | 6-Iodoisoindolin-1-one

AG006G3O

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CAS Number	675109-30-5
Catalog Number	AG006G3O(AGN-PC-03MC0V)
Chemical Name	6-Iodoisoindolin-1-one
IUPAC Name	6-iodo-2,3-dihydroisoindol-1-one
InChI	InChI=1S/C8H6INO/c9-6-2-1-5-4-10-8(11)7(5)3-6/h1-3H,4H2,(H,10,11)
InChI Key	HWGBKJIBYIUGNE-UHFFFAOYSA-N
MDL Number	MFCD13177830
Molecular Formula	C8H6INO
Molecular Weight	259.0438
SMILES	O=C1c2c(CN1)ccc(c2)I
Synonyms	6-iodoisoindolin-1-one, 675109-30-5, 1H-Isoindol-1-one, 2,3-dihydro-6-iodo-, 6-Iodo-2,3-dihydro-1H-isoindol-1-one, SCHEMBL1438328, CTK8C0173, DTXSID90623520, HWGBKJIBYIUGNE-UHFFFAOYSA-N, ZX-RL002036, 6-Iodo-2,3-dihydroisoindol-1-one, 0384AC, 6-iodo-2,3-dihydro-isoindol-1-one, ANW-64289, MFCD13177830, ZINC67175769, AKOS016006178, FCH1380264, 2,3-Dihydro-6-iodo-1H-isoindol-1-one, AS-42972, DA-04425, OR305289, AJ-116906, TC-070675, FT-0719171, L-1025, A1-06380, C8H6INO, AK103986,

Complexity	183
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	258.949g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	259.046g/mol
Monoisotopic Mass	258.949g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	29.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

Lot Number