2-Azidoanisole solution - ≥95%(HPLC), 0.5M in tert-butyl methyl ether , CAS No.20442-97-1

CAS: 20442-97-1 Cat. No.: A465864 Fórmula: C₇H₇N₃O Peso molecular: 149.15 Número CE: 683-601-6

GRADE & PURITY ≥95%(HPLC), 0.5M in tert-butyl methyl ether

Synonyms

o-Methoxyphenyl azide | XBXJQBGKICADKR-UHFFFAOYSA-N | methoxyphenyl azide | STL192401 | F2157-0473 | AKOS015830668 | 1-Azido-2-methoxybenzene | DTXSID50341975 | Benzene, 1-azido-2-methoxy- | LS-12259 | Anisole, o-azido- | EN300-112612 | o-Azidoanisole | S

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Sinónimos

o-Methoxyphenyl azide | XBXJQBGKICADKR-UHFFFAOYSA-N | methoxyphenyl azide | STL192401 | F2157-0473 | AKOS015830668 | 1-Azido-2-methoxybenzene | DTXSID50341975 | Benzene, 1-azido-2-methoxy- | LS-12259 | Anisole, o-azido- | EN300-112612 | o-Azidoanisole | S

Especificações e pureza

≥95%(HPLC), 0.5M in tert-butyl methyl ether

Condições de armazenamento de armazenamento

Store at -20°C

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥95%(HPLC)

Nomes e identificadores

• Sorrisos canónicos: COC1=CC=CC=C1N=[N+]=[N-]
• IUPAC Name: 1-azido-2-methoxybenzene
• InChIKey: XBXJQBGKICADKR-UHFFFAOYSA-N
• INCHI: 1S/C7H7N3O/c1-11-7-5-3-2-4-6(7)9-10-8/h2-5H,1H3
• SMILES isoméricas: COC1=CC=CC=C1N=[N+]=[N-]
• WGK Alemanha: 3
• Peso molecular: 149.15
• Reaxy-Rn: 2091723
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2091723&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Aniline and substituted anilines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Aniline and substituted anilines
• Intermediate Tree Nodes: Not available
• Direct Parent: Methoxyanilines
• Alternative Parents: Phenylazides Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Azo imides Azo compounds Organic salts Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Methoxyaniline - Anisole - Phenol ether - Phenylazide - Methoxybenzene - Phenoxy compound - Alkyl aryl ether - Azo compound - Azo imide - Ether - Organic salt - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic cation - Aromatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as methoxyanilines. These are organic compound containing an aniline group substituted at one or more positions by a methoxy group.
• External Descriptors: Not available

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

• Ponto de inflamação (°F): -27.4 °F
• Ponto de inflamação (°C): -33 °C
• Peso molecular: 149.150 g/mol
• XLogP3: 2.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 149.059 Da
• Monoisotopic Mass: 149.059 Da
• Topological Polar Surface Area: 23.600 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 165.000
• 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