Home Indole and Oxindoles 550-44-7
550-44-7,MFCD00023063
Catalog No.:AA003HMW
550-44-7 | 2-Methylisoindoline-1,3-dione
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10g
98%
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25g
98%
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100g
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  • Technical Information
  • Properties
  • Literature
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003HMW
Chemical Name:
2-Methylisoindoline-1,3-dione
CAS Number:
550-44-7
Molecular Formula:
C9H7NO2
Molecular Weight:
161.1574
MDL Number:
MFCD00023063
IUPAC Name:
2-methylisoindole-1,3-dione
InChI:
InChI=1S/C9H7NO2/c1-10-8(11)6-4-2-3-5-7(6)9(10)12/h2-5H,1H3
InChI Key:
ZXLYYQUMYFHCLQ-UHFFFAOYSA-N
SMILES:
CN1C(=O)c2c(C1=O)cccc2
EC Number:
208-982-4
UNII:
647UP45J2U
NSC Number:
44059
Properties
Computed Properties
 
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.048g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
161.16g/mol
Monoisotopic Mass:
161.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

Synonyms
 
N-Methylphthalimide 
550-44-7 
N-Methylphthalimide, 98% 
BRN 0124428 
AI3-01393 
ZXLYYQUMYFHCLQ-UHFFFAOYSA-N 
647UP45J2U 
MFCD00023063 
NCGC00164164-02 
NSC44059 
N-methyl phthalimide 
DSSTox_CID_7198 
2-Methylisoindoline-1,3-dione 
AC1L1WK5 
ACMC-1B11U 
DSSTox_RID_78345 
DSSTox_GSID_27198 
SCHEMBL28263 
5-21-10-00273 (Beilstein Handbook Reference) 
1H-Isoindole-1, 2-methyl- 
2-methyl-isoindole-1,3-dione 
CHEMBL172614 
DTXSID5027198 
Phthalimide, N-methyl- 
CTK1H0444 
ZINC332671 
2-methylbenzo[c]azoline-1,3-dione 
KS-00000N1A 
Tox21_400053 
ANW-32232 
NSC-44059 
SBB087509 
STL483065 
2-methylbenzo[c]azolidine-1,3-dione 
1H-Isoindole-1,3(2H)-dione, 2-methyl- 
AKOS002384372 
FR-0021 
MCULE-6170405356 
RL04068 
TRA0068337 
NCGC00164164-01 
NCGC00164164-03 
AJ-19554 
AK-81927 
AN-45833 
2-methylisoindole-1,3-dione 
CAS-550-44-7 
SC-18493 
ZB010659 
2-Methyl-1H-isoindole-1,3(2H)-dione # 
LS-109492 
ST2417096 
TC-120977 
FT-0602347 
M0299 
ST50495742 
UNII-647UP45J2U 
Rivaroxaban Impurity F ( N-Methyl Phthalimide ) 
AE-848/00900046 
W-105590 
methylphthalimide 
C9H7NO2 
N-Methylphthalimide, 98% 5g 
C9-H7-N-O2 
CID11074 
CS-M-42257 
N-Methylphthalimide, 98% - 100G 100g 
EINECS 208-982-4 
2-METHYL-1H-ISOINDOLE-1,3(2H)-DIONE 
NSC 44059 
Literature

Title: Electroreductive coupling of phthalimides with alpha,beta-unsaturated esters: unusual rearrangement of resulting silyl ketene acetals.

Journal: Organic letters 20091105

Title: Structural, vibrational and DFT studies on 2-chloro-1H-isoindole-1,3(2H)-dione and 2-methyl-1H-isoindole-1,3(2H)-dione.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20091015

Title: Radical aminomethylation of unactivated alkenes.

Journal: Organic letters 20080807

Title: Toward prediction of alkane/water partition coefficients.

Journal: Journal of medicinal chemistry 20080710

Title: Control of photophysical properties and photoreactions of aromatic imides by use of intermolecular hydrogen bonding.

Journal: The Journal of organic chemistry 20080704

Title: 5,6-Dichloro-2-(2-hydroxy-phen-yl)-iso-indoline-1,3-dione.

Journal: Acta crystallographica. Section E, Structure reports online 20080501

Title: Synthesis and anti-inflammatory activity of N-phthalimidomethyl 2,3-dideoxy- and 2,3-unsaturated glycosides.

Journal: Carbohydrate research 20070702

Title: Electroreduction of N-methylphthalimide in room temperature ionic liquids under insonated and silent conditions.

Journal: Ultrasonics sonochemistry 20050801

Title: Titanocene-catalyzed coupling of aromatic amides in the presence of organosilanes: a novel route to vicinal diamines and a new class of amine-substituted oligomers.

Journal: The Journal of organic chemistry 20041001

Title: Synthesis of cycloalkynes via photochemical decarboxylation of omega-phthalimidoalkynoates.

Journal: Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20040301

Title: Intracellular accumulation and activity of ampicillin used as free drug and as its phthalimidomethyl or pivaloyloxymethyl ester (pivampicillin) against Listeria monocytogenes in J774 macrophages.

Journal: The Journal of antimicrobial chemotherapy 20031001

Title: Synthesis and biological activity of pyridinium-type acetylcholinesterase inhibitors.

Journal: The Journal of pharmacy and pharmacology 20031001

Title: Photolysis experiments on phosmet, an organophosphorus insecticide.

Journal: Journal of agricultural and food chemistry 20030924

Title: Cell handling, membrane-binding properties, and membrane-penetration modeling approaches of pivampicillin and phthalimidomethylampicillin, two basic esters of ampicillin, in comparison with chloroquine and azithromycin.

Journal: Pharmaceutical research 20030401

Title: Sorption and degradation characteristics of phosmet in two contrasting Australian soils.

Journal: Journal of environmental quality 20020101

Title: Synergistic antiviral effect of PEG-asparaginase (ONCASPAR), with protease inhibitor alone and in combination with RT inhibitors against HIV-1 infected T-cells: a model of HIV-1-induced T-cell lymphoma.

Journal: In vivo (Athens, Greece) 20010101

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