AG003L15

6941-75-9 | 5-Bromoisoindoline-1,3-dione

AG003L15

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CAS Number	6941-75-9
Catalog Number	AG003L15(AGN-PC-0JOCHA)
Chemical Name	5-Bromoisoindoline-1,3-dione
IUPAC Name	5-bromoisoindole-1,3-dione
InChI	InChI=1S/C8H4BrNO2/c9-4-1-2-5-6(3-4)8(12)10-7(5)11/h1-3H,(H,10,11,12)
InChI Key	GNYICZVGHULCHE-UHFFFAOYSA-N
MDL Number	MFCD00466049
Molecular Formula	C8H4BrNO2
Molecular Weight	226.0269
NSC Number	38028
SMILES	BrC=1C=C2C(NC(C2=CC1)=O)=O
Synonyms	4-Bromophthalimide, 6941-75-9, 5-Bromoisoindoline-1,3-dione, 5-Bromo-isoindole-1,3-dione, 4-Bromo phthalimide, 5-Bromo-2,3-Dihydro-1H-Isoindole-1,3-Dione, 5-bromo-1H-isoindole-1,3(2H)-dione, 5-bromoisoindole-1,3-dione, MFCD00466049, 1H-ISOINDOLE-1,3(2H)-DIONE, 5-BROMO-, 5-bromophthalimide, NSC38028, ACMC-209o8b, AC1L5VO2, AC1Q26AD, CBDivE_014103, KSC494C7F, SCHEMBL383829, AC1Q256T, 5-Bro moisoindoline-1,3-dione, CTK3J4172, DTXSID90284615, GNYICZVGHULCHE-UHFFFAOYSA-N, ZINC406661, ACN-S003140, ACT12424, KS-000003QZ, ANW-35673, BBL002462, CB-417, NSC-38028, STK387130, AKOS003234806, AC-2802, AC-8527, AN-7910, CS-W004872, FS-2392, MCULE-6804383479, PB30646, RL04655, TRA0015100, 5-bromo-2H-benzo[c]azoline-1,3-dione, AJ-22493, AK-76620, AM804238, AN-13611, BP-10741, BR-76620, CJ-04079, Q269, SC-13900, SY002956, ZB013670, AB0017483, AB1001484, DB-055274, RT-001905, ST2411888, FT-0617919, ST50561895, 5-bromo-1,3-dihydro-1,3-dioxo-2H-isoindole, S-2110, MFCD00466049 (97+%), 941B759, I10-0602, I10-0681, W-203545, C8H4BrNO2, 5-BROMO-3-HYDROXYISOINDOLIN-1-ONE, AR-1G7356, CID236018, B2009, 5-bromoisoindoline-1,3-dione, 95% - 1G 1g, 573675-39-5, 82499-60-3,

Complexity	241
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.943g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	226.029g/mol
Monoisotopic Mass	224.943g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	46.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number