Ethyl 7-nitroindole-2-carboxylate - ≥98% , CAS No.6960-46-9

CAS: 6960-46-9 Cat. No.: E186091 Summenformel: C11H10N2O4 Molekulargewicht: 234.21 EG-Nummer: 674-195-1
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GRADE & PURITY ≥98%
Synonyms
N-3305 | 7-Chloro-3-ethyl-2H-benzo[e][1,2,4]thiadiazine 1,1-dioxide | Ethyl 7-nitro-1H-indole-2-carboxylate # | SR-01000512230-1 | NSC69878 | NSC-69878 | A836560 | SCHEMBL1016404 | MFCD00216475 | Indole-2-carboxylic acid, 7-nitro-, ethyl ester | SY062659
Storage
Store at 2-8°C,Desiccated
Shipped In
Wet ice
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Size
Deutschland (EU)
USA*
Price
Qty
1g
E186091-1g
Auf Bestellung · 8–12 Wochen

8,59€

12,93€
Speichern 4,34 € (33.56%)
5g
E186091-5g
Auf Bestellung · 8–12 Wochen

16,40€

25,08€
Speichern 8,68 € (34.60%)
25g
E186091-25g
Auf Bestellung · 8–12 Wochen

71,94€

108,38€
Speichern 36,45 € (33.63%)
100g
E186091-100g
Auf Bestellung · 8–12 Wochen
458,08€
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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Desiccated Ships Wet ice 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.

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Literature proof

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

Specifications

Synonyme
N-3305 | 7-Chloro-3-ethyl-2H-benzo[e][1,2,4]thiadiazine 1,1-dioxide | Ethyl 7-nitro-1H-indole-2-carboxylate # | SR-01000512230-1 | NSC69878 | NSC-69878 | A836560 | SCHEMBL1016404 | MFCD00216475 | Indole-2-carboxylic acid, 7-nitro-, ethyl ester | SY062659
Spezifikationen & Reinheit
≥98%
Storage
Store at 2-8°C,Desiccated
Verschickt in
Wet ice
Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.
Reinheit
≥98%
Namen und Kennungen
Kanonisches LächelnCCOC(=O)C1=CC2=C(N1)C(=CC=C2)[N+](=O)[O-]
IUPAC Nameethyl 7-nitro-1H-indole-2-carboxylate
InChIKeyGTZAIVBXGPLYGD-UHFFFAOYSA-N
INCHI1S/C11H10N2O4/c1-2-17-11(14)8-6-7-4-3-5-9(13(15)16)10(7)12-8/h3-6,12H,2H2,1H3
Isomere SMILES CCOC(=O)C1=CC2=C(N1)C(=CC=C2)[N+](=O)[O-]
Molekulargewicht 234.21
Reaxy-Rn 224930
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=224930&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
KlasseIndoles and derivatives
SubclassIndolecarboxylic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentIndolecarboxylic acids and derivatives
Alternative Parents Indoles  Pyrrole carboxylic acids and derivatives  Nitroaromatic compounds  Substituted pyrroles  Benzenoids  Heteroaromatic compounds  Carboxylic acid esters  Propargyl-type 1,3-dipolar organic compounds  Azacyclic compounds  Organic oxoazanium compounds  Monocarboxylic acids and derivatives  Hydrocarbon derivatives  Organic oxides  Organonitrogen compounds  Organooxygen compounds  Organopnictogen compounds  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Indolecarboxylic acid derivative - Indole - Nitroaromatic compound - Pyrrole-2-carboxylic acid or derivatives - Substituted pyrrole - Benzenoid - Pyrrole - Heteroaromatic compound - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organic oxoazanium - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as indolecarboxylic acids and derivatives. These are compounds containing a carboxylic acid group (or a derivative thereof) linked to an indole.
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:
Chemische und physikalische Eigenschaften
Molekulargewicht234.210 g/mol
XLogP33.000
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass234.064 Da
Monoisotopic Mass234.064 Da
Topological Polar Surface Area87.900 Ų
Heavy Atom Count17
Formal Charge0
Complexity315.000
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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