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

CAS: 20442-97-1 Cat. No.: A465864 Formule: C₇H₇N₃O Poids moléculaire: 149.15 Numéro 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

Synonymes

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

Spécifications et pureté

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

Conditions de stockage de stockage

Store at -20°C

Expédié en

Ice chest + Ice pads

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥95%(HPLC)

Noms et identifiants

• Sourires canoniques: 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
• Isomères SMILES: COC1=CC=CC=C1N=[N+]=[N-]
• WGK Allemagne: 3
• Poids moléculaire: 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
• Description: 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

Propriétés chimiques et physiques

• Point d'éclair (°F): -27.4 °F
• Point d'éclair (°C): -33 °C
• Poids moléculaire: 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