Benzo[e]isatin - ≥97% , CAS No.5588-87-4

CAS: 5588-87-4 Cat. No.: B696299 Summenformel: C12H7NO2 Molekulargewicht: 197.19
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GRADE & PURITY ≥97%
Synonyms
4,5-Benzoisatin | 1H-Benz[e]indole-1,2(3H)-dione | 3H-benzo[e]indole-1,2-dione | Benz(e)isatin | benzindole-2,3-dione | 1H-benzo[e]indole-1,2(3H)-dione
Storage
Protected from light,Room temperature
Shipped In
Normal
Size
Deutschland (EU)
USA*
Price
Qty
50mg
B696299-50mg
Auf Bestellung · 8–12 Wochen
25,95€
250mg
B696299-250mg
Auf Bestellung · 8–12 Wochen
78,01€
1g
B696299-1g
Auf Bestellung · 8–12 Wochen
208,17€
Enter a quantity for the sizes you want to add.
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Why this grade

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

🌡

Storage & shipping

Protected from light,Room temperature Ships Normal Check lot-specific COA for exact specifications.

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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

Synonyme
4,5-Benzoisatin | 1H-Benz[e]indole-1,2(3H)-dione | 3H-benzo[e]indole-1,2-dione | Benz(e)isatin | benzindole-2,3-dione | 1H-benzo[e]indole-1,2(3H)-dione
Spezifikationen & Reinheit
≥97%
Storage
Protected from light,Room temperature
Verschickt in
Normal
Reinheit
≥97%
Namen und Kennungen
Kanonisches LächelnC1=CC=C2C(=C1)C=CC3=C2C(=O)C(=O)N3
IUPAC Name3H-benzo[e]indole-1,2-dione
InChIKeyRVZFBDVLNFODOM-UHFFFAOYSA-N
INCHI1S/C12H7NO2/c14-11-10-8-4-2-1-3-7(8)5-6-9(10)13-12(11)15/h1-6H,(H,13,14,15)
Isomere SMILES C1=CC=C2C(=C1)C=CC3=C2C(=O)C(=O)N3
Alternative CAS-Nummer 5588-87-4
Molekulargewicht 197.19

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
SuperclassBenzenoids
KlasseNaphthalenes
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentNaphthalenes
Alternative Parents Indolines  Aryl ketones  Vinylogous amides  Secondary carboxylic acid amides  Lactams  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Naphthalene - Indole or derivatives - Dihydroindole - Aryl ketone - Vinylogous amide - Carboxamide group - Ketone - Lactam - Secondary carboxylic acid amide - Carboxylic acid derivative - Azacycle - Organoheterocyclic compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
External Descriptors Not available
3D-Struktur
Interaktives chemisches Strukturmodell





Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
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.

3 results found

Lot NumberCertificate TypeDatumArtikel
I2603681Certificate of AnalysisMar 27, 2026 B696299
I2603684Certificate of AnalysisMar 27, 2026 B696299
I2603704Certificate of AnalysisMar 27, 2026 B696299
Chemische und physikalische Eigenschaften
EmpfindlichkeitLight sensitive
Schmelzpunkt (°C)180-200℃
Molekulargewicht197.190 g/mol
XLogP32.000
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass197.048 Da
Monoisotopic Mass197.048 Da
Topological Polar Surface Area46.200 Ų
Heavy Atom Count15
Formal Charge0
Complexity313.000
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
Lösungsrechner
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