200,000+ products from a single source!
sales@angenechem.com
Home > Indoles and Oxindole > 496-12-8
496-12-8 | Isoindoline
CAS No: 496-12-8 Catalog No: AG003R3V MDL No:MFCD00605324
Product Description
Catalog Number:
AG003R3V
Chemical Name:
Isoindoline
CAS Number:
496-12-8
Molecular Formula:
C8H9N
Molecular Weight:
119.1638
MDL Number:
MFCD00605324
IUPAC Name:
2,3-dihydro-1H-isoindole
InChI:
InChI=1S/C8H9N/c1-2-4-8-6-9-5-7(8)3-1/h1-4,9H,5-6H2
InChI Key:
GWVMLCQWXVFZCN-UHFFFAOYSA-N
SMILES:
N1Cc2c(C1)cccc2
Properties
Complexity:
88.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
119.073g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
119.167g/mol
Monoisotopic Mass:
119.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Literature
| Title | Journal |
|---|---|
| Sulfonate pseudohalides of boron subphthalocyanine. | Acta crystallographica. Section C, Crystal structure communications 20121101 |
| N-(1,3-Dioxo-2,3-dihydro-1H-isoindol-2-yl)-4,4''-difluoro-5'-hy-droxy-1,1':3',1''-terphenyl-4'-carboxamide. | Acta crystallographica. Section E, Structure reports online 20120901 |
| Computational design of cyclic nitroxides as efficient redox mediators for dye-sensitized solar cells. | Chemistry (Weinheim an der Bergstrasse, Germany) 20120611 |
| 2-Benzyl-3-hy-droxy-3-methyl-2,3-dihydro-1H-isoindol-1-one. | Acta crystallographica. Section E, Structure reports online 20120601 |
| Rhodium-catalyzed synthesis of branched amines by direct addition of benzamides to imines. | Organic letters 20120504 |
| Synthesis of the HCV protease inhibitor Vaniprevir (MK-7009) using ring-closing metathesis strategy. | The Journal of organic chemistry 20120420 |
| Dynamic kinetic resolution of 1,3-dihydro-2H-isoindole-1-carboxylic acid methyl ester: asymmetric transformations toward isoindoline carbamates. | Organic letters 20120406 |
| Synthesis of a unique isoindoline/tetrahydroisoquinoline-based tricyclic sultam library utilizing a Heck-aza-Michael strategy. | ACS combinatorial science 20120312 |
| 1,1,3,3-Tetra-ethyl-isoindolin-2-ium chloride. | Acta crystallographica. Section E, Structure reports online 20120301 |
| 2-[(E)-(2-Hy-droxy-naphthalen-1-yl)methyl-idene-amino]-isoindoline-1,3-dione. | Acta crystallographica. Section E, Structure reports online 20111201 |
| (E)-2-[(2-Chloro-benzyl-idene)amino]-isoindoline-1,3-dione. | Acta crystallographica. Section E, Structure reports online 20111201 |
| Structure-activity relationship studies on isoindoline inhibitors of dipeptidyl peptidases 8 and 9 (DPP8, DPP9): is DPP8-selectivity an attainable goal? | Journal of medicinal chemistry 20110825 |
| 1,3-Bis[3-(1,3-dioxoisoindolin-2-yl)prop-yl]-1H-anthra[1,2-d]imidazole-2,6,11(3H)-trione. | Acta crystallographica. Section E, Structure reports online 20110801 |
| 2-[(E)-(2,4-Dichloro-benzyl-idene)amino]-isoindoline-1,3-dione. | Acta crystallographica. Section E, Structure reports online 20110701 |
| Discovery of isoindoline and tetrahydroisoquinoline derivatives as potent, selective PPARδ agonists. | Bioorganic & medicinal chemistry letters 20110101 |
| Structural determination of three different series of compounds as Hsp90 inhibitors using 3D-QSAR modeling, molecular docking and molecular dynamics methods. | International journal of molecular sciences 20110101 |
| Synthesis and pharmacological characterization of potent, selective, and orally bioavailable isoindoline class dipeptidyl peptidase IV inhibitors. | Organic and medicinal chemistry letters 20110101 |
| 2-{[(E)-2-Hy-droxy-benzyl-idene]amino}-1H-isoindole-1,3(2H)-dione. | Acta crystallographica. Section E, Structure reports online 20101101 |
| Side reactions of nitroxide-mediated polymerization: N-O versus O-C cleavage of alkoxyamines. | The journal of physical chemistry. A 20100930 |
| 4,5,6,7-Tetra-chloro-2-(2,2,2-trifluoro-eth-yl)isoindoline-1,3-dione. | Acta crystallographica. Section E, Structure reports online 20100701 |
| Rearrangements and intramolecular Diels-Alder reactions of normal and vinylogous aza-Morita-Baylis-Hillman products leading to isoindoline derivatives. | The Journal of organic chemistry 20100604 |
| 2-{[(4-Methoxy-phen-yl)dimethyl-silyl]meth-yl}isoindoline-1,3-dione. | Acta crystallographica. Section E, Structure reports online 20100101 |
| Does the sedative agent, JM-1232(-) cause QT prolongation with subsequent torsades de pointes? | Life sciences 20091118 |
| 2-(1,3-Dioxoisoindolin-2-yl)propanoic acid. | Acta crystallographica. Section E, Structure reports online 20091101 |
| 1,2-Bis(bromo-meth-yl)-4,5-dimethoxy-benzene. | Acta crystallographica. Section E, Structure reports online 20090901 |
| 2-[2-(2-Pyrid-yl)eth-yl]isoindolinium perchlorate. | Acta crystallographica. Section E, Structure reports online 20090901 |
| 2-[2-(Methyl-sulfon-yl)eth-yl]isoindoline-1,3-dione. | Acta crystallographica. Section E, Structure reports online 20090801 |
| The shivering threshold in rabbits with JM-1232(-), a new benzodiazepine receptor agonist. | Anesthesia and analgesia 20090701 |
| 3',6'-Bis(diethyl-amino)-2-phenyl-spiro[isoindoline-1,9'-xanthen]-3-one. | Acta crystallographica. Section E, Structure reports online 20090701 |
| The antinociceptive effects and pharmacological properties of JM-1232(-): a novel isoindoline derivative. | Anesthesia and analgesia 20090301 |
| Bishydrazide derivatives of isoindoline as simple anion receptors. | The Journal of organic chemistry 20090220 |
| N-Benzyl-1-heteroaryl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamides as inhibitors of co-activator associated arginine methyltransferase 1 (CARM1). | Bioorganic & medicinal chemistry letters 20090215 |
| 1,3-Di-1-adamantylimidazolium (phthalocyaninato)lithium(I) acetone hemisolvate monohydrate. | Acta crystallographica. Section E, Structure reports online 20090101 |
| Experimental and theoretical studies of the redox potentials of cyclic nitroxides. | The Journal of organic chemistry 20080905 |
| Inhibitors of dipeptidyl peptidase 8 and dipeptidyl peptidase 9. Part 2: isoindoline containing inhibitors. | Bioorganic & medicinal chemistry letters 20080715 |
| Interplay of hydrogenation and dehydrogenation in isoindoline and indoline isomers: a density functional theory study. | The journal of physical chemistry. A 20080612 |
| Synthesis of 5,15-diaryltetrabenzoporphyrins. | The Journal of organic chemistry 20080606 |
| 5,6-Dichloro-2-(3-methoxy-phen-yl)isoindoline-1,3-dione. | Acta crystallographica. Section E, Structure reports online 20080501 |
| 5,6-Dichloro-2-(2-fluoro-phen-yl)iso-indoline-1,3-dione. | Acta crystallographica. Section E, Structure reports online 20080501 |
| Raman identification of yellow synthetic organic pigments in modern and contemporary paintings: reference spectra and case studies. | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20080201 |
| 2-(4-Amino-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-ylmeth-yl)isoindoline-1,3-dione. | Acta crystallographica. Section E, Structure reports online 20080201 |
| Microwave-mediated nickel-catalyzed cyclotrimerization reactions: total synthesis of illudinine. | The Journal of organic chemistry 20080104 |
| Asymmetric Brønsted acid catalyzed isoindoline synthesis: enhancement of enantiomeric ratio by stereoablative kinetic resolution. | Angewandte Chemie (International ed. in English) 20080101 |
| Crystal structures of the FAK kinase in complex with TAE226 and related bis-anilino pyrimidine inhibitors reveal a helical DFG conformation. | PloS one 20080101 |
| Bis[1,3-bis-(diphenyl-phosphinoylimino)isoindolinato-κO,N,O']calcium(II). | Acta crystallographica. Section E, Structure reports online 20080101 |
| One-electron oxidation and reduction potentials of nitroxide antioxidants: a theoretical study. | The journal of physical chemistry. A 20071227 |
| Formation of 4,5,6,7-tetrahydroisoindoles by palladium-catalyzed hydride reduction. | The Journal of organic chemistry 20071123 |
| Isothiazoloquinolones with enhanced antistaphylococcal activities against multidrug-resistant strains: effects of structural modifications at the 6-, 7-, and 8-positions. | Journal of medicinal chemistry 20070125 |
| Patented small molecule inhibitors in the ubiquitin proteasome system. | BMC biochemistry 20070101 |
| Size discrimination in the coordination chemistry of an isoindoline pincer ligand with CdII and ZnII. | Inorganic chemistry 20060724 |
| Solid-supported [2+2+2] cyclotrimerizations. | Chemistry (Weinheim an der Bergstrasse, Germany) 20060717 |
| Synthesis, structure and DNA interaction of cobalt(III) bis-complexes of 1,3-bis(2-pyridylimino)isoindoline and 1,4,7-triazacyclononane. | Journal of inorganic biochemistry 20051101 |
| Cd(II), Zn(II), and Pd(II) complexes of an isoindoline pincer ligand: consequences of steric crowding. | Inorganic chemistry 20050905 |
| Novel isoindoline compounds for potent and selective inhibition of prolyl dipeptidase DPP8. | Bioorganic & medicinal chemistry letters 20050201 |
| Synthesis and biological evaluation of pyrrolo[2,1-c][1,4]benzodiazepine (PBD) C8 cyclic amine conjugates. | Bioorganic & medicinal chemistry letters 20040223 |
| Intermolecular, markovnikov hydroamination of vinylarenes with alkylamines. | Journal of the American Chemical Society 20031126 |
| Design and synthesis of trans-3-(2-(4-((3-(3-(5-methyl-1,2,4-oxadiazolyl))- phenyl)carboxamido)cyclohexyl)ethyl)-7-methylsulfonyl-2,3,4,5-tetrahydro-1H-3-benzazepine (SB-414796): a potent and selective dopamine D3 receptor antagonist. | Journal of medicinal chemistry 20031106 |
| Fluxional behavior of a cadmium zwitterion complex: proton transport and tautomerism in methylene chloride solution. | Inorganic chemistry 20030728 |
| A novel isoindoline, porritoxin sulfonic acid, from Alternaria porri and the structure-phytotoxicity correlation of its related compounds. | Bioscience, biotechnology, and biochemistry 20030701 |
| Syntheses and structures of isoindoline complexes of Zn(II) and Cu(II): an unexpected trinuclear Zn(II) complex. | Inorganic chemistry 20030113 |
| Synthesis and structure-activity relationship of the isoindolinyl benzisoxazolpiperidines as potent, selective, and orally active human dopamine D4 receptor antagonists. | Chembiochem : a European journal of chemical biology 20021004 |
| Synthesis and SAR studies for the inhibition of TNF-alpha production. Part 2. 2-[3-(Cyclopentyloxy)-4-methoxyphenyl]-substituted-1-isoindolinone derivatives. | Archives of pharmacal research 20020401 |
| [Nickel-catalyzed [2 + 2 + 2] cocyclization and its application to the synthetic organic chemistry]. | Yakugaku zasshi : Journal of the Pharmaceutical Society of Japan 20011201 |
| cis-6-Phenyl-4bH,6H,11H,13H-isoindolo[1,2-c]benz[2,4]oxazepin-13-one. | Acta crystallographica. Section C, Crystal structure communications 20010601 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.