4-cyano-1H-indazole-3-carboxylic acid - ≥97% , CAS No.1000341-33-2

CAS: 1000341-33-2 Cat. No.: C626452 Peso molecular: 187.16 Número EC: 965-613-6 PubChem CID: 24729346
Disponible para pedir
GRADE & PURITY ≥97%
Synonyms
SY323986 | P20925 | 1000341-33-2 | DTXSID10646711 | EN300-2657243 | MFCD09263233 | 4-Cyano-3-(1H)indazole carboxylic acid | SB30007 | 4-Cyanoindazole-3-carboxylic Acid | AKOS006330682 | 4-cyano-1H-indazole-3-carboxylic acid | BS-42707 | 1H-Indazole-3-carb
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
250mg
C626452-250mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
184,90US$
500mg
C626452-500mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
276,90US$
1g
C626452-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
461,90US$
5g
C626452-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
1.848,90US$
10g
C626452-10g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
3.696,90US$
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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
SY323986 | P20925 | 1000341-33-2 | DTXSID10646711 | EN300-2657243 | MFCD09263233 | 4-Cyano-3-(1H)indazole carboxylic acid | SB30007 | 4-Cyanoindazole-3-carboxylic Acid | AKOS006330682 | 4-cyano-1H-indazole-3-carboxylic acid | BS-42707 | 1H-Indazole-3-carb
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥97%
Nombres e identificadores
Sonrisas canónicasC1=CC(=C2C(=C1)NN=C2C(=O)O)C#N
IUPAC Name4-cyano-1H-indazole-3-carboxylic acid
InChIKeyXTNCDNOZENBPPA-UHFFFAOYSA-N
INCHI1S/C9H5N3O2/c10-4-5-2-1-3-6-7(5)8(9(13)14)12-11-6/h1-3H,(H,11,12)(H,13,14)
Isómeros SMILES C1=CC(=C2C(=C1)NN=C2C(=O)O)C#N
CAS alternativo 1000341-33-2
PubChem CID 24729346
Peso molecular 187.16

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
ClaseBenzopyrazoles
SubclassIndazoles
Intermediate Tree Nodes Not available
Direct ParentIndazoles
Alternative Parents Pyrazole carboxylic acids and derivatives  Benzenoids  Heteroaromatic compounds  Nitriles  Carboxylic acids  Azacyclic compounds  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Benzopyrazole - Indazole - Pyrazole-5-carboxylic acid or derivatives - Pyrazole-3-carboxylic acid or derivatives - Benzenoid - Azole - Heteroaromatic compound - Pyrazole - Carboxylic acid derivative - Carboxylic acid - Carbonitrile - Nitrile - Azacycle - Cyanide - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as indazoles. These are compounds containing an indazole, which is structurally characterized by a pyrazole fused to a benzene.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
Peso molecular187.150 g/mol
XLogP31.100
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass187.038 Da
Monoisotopic Mass187.038 Da
Topological Polar Surface Area89.800 Ų
Heavy Atom Count14
Formal Charge0
Complexity296.000
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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