AG007NN4

2436-29-5 | 3-(1,3-Dioxoisoindol-2-yl)propanal

AG007NN4

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CAS Number	2436-29-5
Catalog Number	AG007NN4(AGN-PC-0JLPF0)
Chemical Name	3-(1,3-Dioxoisoindol-2-yl)propanal
EC Number	700-133-0
IUPAC Name	3-(1,3-dioxoisoindol-2-yl)propanal
InChI	InChI=1S/C11H9NO3/c13-7-3-6-12-10(14)8-4-1-2-5-9(8)11(12)15/h1-2,4-5,7H,3,6H2
InChI Key	IBSDSIHTMABATG-UHFFFAOYSA-N
MDL Number	MFCD01704466
Molecular Formula	C11H9NO3
Molecular Weight	203.1941
NSC Number	166600
SMILES	O=CCCN(C(C1=C2C=CC=C1)=O)C2=O
Synonyms	2436-29-5, 3-(1,3-Dioxoisoindolin-2-yl)propanal, 3-Phthalimidopropionaldehyde, 3-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-propionaldehyde, 3-(1,3-dioxoisoindol-2-yl)propanal, Phthalimide, N-(2-formylethyl)-, 3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanal, beta-Phthalimidopropionaldehyde, 3-Phthalimidylpropanal, 2H-Isoindole-2-propanal, 1,3-dihydro-1,3-dioxo-, NSC 166600, BRN 0165375, n-(2-formylethyl)phthalimide, NSC166600, 3-Phthalimidopropanal, 3-phthalimidopropanaldehyde, EC 700-133-0, n-(3-oxopropyl)phthalimide, AC1L2OY7, 5-21-10-00396 (Beilstein Handbook Reference), KSC494K3T, 3-phthalimidopropionic aldehyde, SCHEMBL1042197, WLN: T56 BVNVJ C2VH, .beta.-Phthalimidopropionaldehyde, CTK3J4539, DTXSID90179097, IBSDSIHTMABATG-UHFFFAOYSA-N, 3-(Phthalimid-1-yl)propionaldehyde, ALBB-027203, ZINC1659762, MFCD01704466, 3-(1,3-dioxo-2-isoindolyl)propanal, 2-(3-Oxopropyl)isoindole-1,3-dione, AKOS012339440, MCULE-2356509739, NSC-166600, 2-(3-oxopropyl)isoindoline-1,3-dione, AJ-28905, AK116402, AN-50904, AS-44947, CJ-06002, SC-31630, AB0032200, LS-109472, RT-002062, FT-0654488, R4833, ST24041351, X5486, 3-(1,3-dioxo-1,3-dihydro-isoindol-2-yl)-, 2H-Isoindole-2-propanal,3-dihydro-1,3-dioxo-, 1,3-Dihydro-1,3-dioxo-2H-isoindole-2-propanal, 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanal, 436D295, A817246, H111027, I14-1595, 3-(1,3-Dihydro-1,3-dioxo-2H-isoindol-2-yl)propanal, 3-(1,3-dioxo-1,3-dihydroisoindol-2-yl)propionaldehyde, 3-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)propanal, 2H-Isoindole-2-propanal, 1,3-dihydro-1,3-dioxo- (9CI), 3-(1,3-DIOXO-1,3-DIHYDroisoINDOL-2-yl)propaNALDEHYDE, 3-[(1,3-dioxo-1,3-dihydro-2h-isoindole)-2-yl]propanal, 3-(1,3-DIOXO-1,3-DIHYDRO-ISOINDOL-2-YL)-PROPIONALD, 3-(1,3-dioxo-1,3-dihydro-isoindol-2-yl)-propionaldehyde, AldrichCPR, C11H9NO3, C11-H9-N-O3, CID75525, ACN-052032,

Complexity	276
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	203.058g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	203.197g/mol
Monoisotopic Mass	203.058g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	54.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

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