Variamine Blue B Base [Indicador Redox] - ≥98%(T) , CAS No.101-64-4

CAS: 101-64-4 Cat. No.: V162976 Peso molecular: 214.27 Número EC: 202-962-9 PubChem CID: 66869

GRADE & PURITY ≥98%(T)

Synonyms

4-Metoxi-4'-aminodifenilamina | AS-57562 | MFCD00070553 | Variamine blue base | 4-(4-METHOXIFENILAMINO)ANILINA | CBMicro_022749 | AKOS000286372 | D91340 | N-(P-METHOXIFENIL)-P-P-FENILENEDIAMINA [MI] | EINECS 202-962-9 | cid_66869 | N1-(4-metoxifenil)

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

4-Metoxi-4'-aminodifenilamina | AS-57562 | MFCD00070553 | Variamine blue base | 4-(4-METHOXIFENILAMINO)ANILINA | CBMicro_022749 | AKOS000286372 | D91340 | N-(P-METHOXIFENIL)-P-P-FENILENEDIAMINA [MI] | EINECS 202-962-9 | cid_66869 | N1-(4-metoxifenil)

Especificaciones y pureza

≥98%(T)

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%(T)

Nombres e identificadores

• Pubchem Sid: 488183867
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488183867
• Sonrisas canónicas: COC1=CC=C(C=C1)NC2=CC=C(C=C2)N
• IUPAC Name: 4-N-(4-methoxyphenyl)benzene-1,4-diamine
• InChIKey: RBLUJIWKMSZIMK-UHFFFAOYSA-N
• INCHI: 1S/C13H14N2O/c1-16-13-8-6-12(7-9-13)15-11-4-2-10(14)3-5-11/h2-9,15H,14H2,1H3
• Isómeros SMILES: COC1=CC=C(C=C1)NC2=CC=C(C=C2)N
• PubChem CID: 66869
• Peso molecular: 214.27
• Reaxy-Rn: 2213141

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Phenol ethers
      • Subclass Aminophenyl ethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Phenol ethers
• Subclass: Aminophenyl ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Aminophenyl ethers
• Alternative Parents: Methoxyanilines Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Secondary amines Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aminophenyl ether - Methoxyaniline - Phenoxy compound - Anisole - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Ether - Secondary amine - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as aminophenyl ethers. These are aromatic compounds that contain a phenol ether, which carries an amine group on the benzene ring.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Punto de ebullición (°C): 210°C/4mmHg(lit.)
• Punto de fusión (°C): 101 °C
• Peso molecular: 214.260 g/mol
• XLogP3: 2.500
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 214.111 Da
• Monoisotopic Mass: 214.111 Da
• Topological Polar Surface Area: 47.300 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 194.000
• 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