1-Isoindolinone - ≥97% , CAS No.480-91-1

CAS: 480-91-1 Cat. No.: I170551 Peso molecular: 133.15 Número EC: 806-895-1
Disponible para pedir
GRADE & PURITY ≥97%
Synonyms
1-Isoindolinone # | 3,4-BENZOPYRROLIDONE | 1-oxo-isoindoline | AB13096 | I1064 | 1-Isoindolinone | CHEBI:74235 | SY020116 | DTXSID30197391 | BB 0258318 | NSC 3689 | isoindolin-1-one;1-Isoindolinone | Phthalimidine | Benzo(3,4)pyrrolidone-2 | A7325 | Z3625
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
250mg
I170551-250mg
2
9,90US$
1g
I170551-1g
5
10,90US$
5g
I170551-5g
3

17,90US$

26,90US$
Guardar 9,00 US$ (33.46%)
25g
I170551-25g
1

76,90US$

115,90US$
Guardar 39,00 US$ (33.65%)
100g
I170551-100g
1

196,90US$

295,90US$
Guardar 99,00 US$ (33.46%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
1-Isoindolinone # | 3, 4-BENZOPYRROLIDONE | 1-oxo-isoindoline | AB13096 | I1064 | 1-Isoindolinone | CHEBI:74235 | SY020116 | DTXSID30197391 | BB 0258318 | NSC 3689 | isoindolin-1-one;1-Isoindolinone | Phthalimidine | Benzo(3, 4)pyrrolidone-2 | A7325 | Z3625
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥97%
Nombres e identificadores
Pubchem Sid488181088
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488181088
Sonrisas canónicasC1C2=CC=CC=C2C(=O)N1
IUPAC Name2,3-dihydroisoindol-1-one
InChIKeyPXZQEOJJUGGUIB-UHFFFAOYSA-N
INCHI1S/C8H7NO/c10-8-7-4-2-1-3-6(7)5-9-8/h1-4H,5H2,(H,9,10)
Isómeros SMILES C1C2=CC=CC=C2C(=O)N1
Peso molecular 133.15
Reaxy-Rn 115010
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=115010&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClaseIsoindoles and derivatives
SubclassIsoindolines
Intermediate Tree Nodes Not available
Direct ParentIsoindolones
Alternative Parents Isoindoles  Benzenoids  Secondary carboxylic acid amides  Lactams  Azacyclic compounds  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Isoindolone - Isoindole - Benzenoid - Carboxamide group - Lactam - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as isoindolones. These are aromatic polycyclic compounds that an isoindole bearing a ketone.
External Descriptors gamma-lactam - isoindoles
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
CA12 Tclin Carbonic anhydrase 12 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
CA9 Tclin Carbonic anhydrase 9 (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)
CA2 Tclin Carbonic anhydrase II (17698 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA1 Tclin Carbonic anhydrase I (13240 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA12 Tclin Carbonic anhydrase XII (6231 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA9 Tclin Carbonic anhydrase IX (8255 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

11 results found

Lot NumberCertificate TypeFechaArticulo
D2609609Certificate of AnalysisApr 10, 2026 I170551
E2323260Certificate of AnalysisMar 11, 2026 I170551
E2323262Certificate of AnalysisMar 11, 2026 I170551
E2323265Certificate of AnalysisMar 11, 2026 I170551
E2323266Certificate of AnalysisMar 11, 2026 I170551
E2323268Certificate of AnalysisMar 11, 2026 I170551
E2323269Certificate of AnalysisMar 11, 2026 I170551
E2323270Certificate of AnalysisMar 11, 2026 I170551
E2323271Certificate of AnalysisMar 11, 2026 I170551
E2323272Certificate of AnalysisMar 11, 2026 I170551
E2323279Certificate of AnalysisMar 11, 2026 I170551

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Propiedades químicas y físicas
Punto de ebullición (°C)337 °C
Punto de fusión (°C)151 °C
Peso molecular133.150 g/mol
XLogP30.800
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass133.053 Da
Monoisotopic Mass133.053 Da
Topological Polar Surface Area29.100 Ų
Heavy Atom Count10
Formal Charge0
Complexity155.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluciones
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