Indole-3-acetamida - ≥98% , CAS No.879-37-8

CAS: 879-37-8 Cat. No.: I123331 Fórmula: C₁₀H₁₀N₂O Peso molecular: 174.2 Beilstein Registry Number: 22(5)370 Número CE: 212-904-4

GRAU & PUREZA ≥98%

Synonyms

AKOS001129741 | bmse000696 | I0668 | InChI=1/C10H10N2O/c11-10(13)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,12H,5H2,(H2,11,13) | 2-(3-Indolyl)acetamide | 3-Indoleacetamide | SB15031 | SY014237 | (1H-indol-3-yl)acetamide | AM1212 | C10H10N2O | Indole-3-acetamide (8CI

Storage

Argon charged,Room temperature

Shipped In

Normal

Visão geral

Descrição do Produto：

A indole-3-acetamida é um precursor da auxina.

Aplicação do Produto：

A indole-3-acetamida foi utilizada na síntese do esqueleto [5.5.6.6]diazafenestrano e do ácido indol-3-acético.

Reactante para a síntese de:

Agente PET para imagiologia da proteína quinase C

Um potencial agente contra a doença de Prion

Inibidor da proteína quinase C (PKC) bisindolilmaleimida IV

Inibidores da glicogénio sintase cinase-3ß (GSK-3ß)

Inibidores da CaMKIId

Um inibidor do VEGF

Especificações

Sinónimos

AKOS001129741 | bmse000696 | I0668 | InChI=1/C10H10N2O/c11-10(13)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,12H,5H2,(H2,11,13) | 2-(3-Indolyl)acetamide | 3-Indoleacetamide | SB15031 | SY014237 | (1H-indol-3-yl)acetamide | AM1212 | C10H10N2O | Indole-3-acetamide (8CI

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Argon charged,Room temperature

Enviado em

Normal

Pureza

≥98%

Nomes e identificadores

Pubchem Sid

488179520

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488179520

Sorrisos canónicos

C1=CC=C2C(=C1)C(=CN2)CC(=O)N

IUPAC Name

2-(1H-indol-3-yl)acetamide

InChIKey

ZOAMBXDOGPRZLP-UHFFFAOYSA-N

INCHI

1S/C10H10N2O/c11-10(13)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,12H,5H2,(H2,11,13)

SMILES isoméricas

C1=CC=C2C(=C1)C(=CN2)CC(=O)N

WGK Alemanha

3

Peso molecular

174.2

Beilstein

22(5)370

Reaxy-Rn

143368

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=143368&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Indoles and derivatives
      • Subclass Indoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Indoles and derivatives
• Subclass: Indoles
• Intermediate Tree Nodes: Not available
• Direct Parent: 3-alkylindoles
• Alternative Parents: Substituted pyrroles Benzenoids Heteroaromatic compounds Carboximidic acids Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: 3-alkylindole - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Azacycle - Carboximidic acid derivative - Carboximidic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as 3-alkylindoles. These are compounds containing an indole moiety that carries an alkyl chain at the 3-position.
• External Descriptors: a small molecule

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propriedades químicas e físicas

• Solubilidade: Soluble in Methanol
• Sensibilidade: light & air sensitive
• Ponto de fusão (°C): 153°C
• Peso molecular: 174.200 g/mol
• XLogP3: 0.800
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 174.079 Da
• Monoisotopic Mass: 174.079 Da
• Topological Polar Surface Area: 58.900 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 205.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 879-37-8, the molecular formula is C10H10N2O, and the molecular weight is 174.2 g/mol. InChIKey ZOAMBXDOGPRZLP-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.