3-Methoxy-2-methylaniline - ≥98% , CAS No.19500-02-8

CAS: 19500-02-8 Cat. No.: M122543 Fórmula: C₈H₁₁NO Peso molecular: 137.18 Beilstein Registry Number: 13(3)1538 Número EC: 677-461-5

GRADE & PURITY ≥98%

Synonyms

A4286 | MFCD06412568 | 3-amino-1-methoxy-2-methylbenzene | 3-methoxy-2-methylbenzenamine;3-Methoxy-2-methylaniline | AC-1678 | STL556763 | 3-Methoxy-2-methyl phenylamine | TS-01770 | 2-Amino-6-methoxy-toluol | 1-methoxy-2-methyl-3-aminobenzene | 1-Amino-3

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

A4286 | MFCD06412568 | 3-amino-1-methoxy-2-methylbenzene | 3-methoxy-2-methylbenzenamine;3-Methoxy-2-methylaniline | AC-1678 | STL556763 | 3-Methoxy-2-methyl phenylamine | TS-01770 | 2-Amino-6-methoxy-toluol | 1-methoxy-2-methyl-3-aminobenzene | 1-Amino-3

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C,Protected from light,Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504766744
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504766744
• Sonrisas canónicas: CC1=C(C=CC=C1OC)N
• IUPAC Name: 3-methoxy-2-methylaniline
• InChIKey: OPXLVWLFDKRYRB-UHFFFAOYSA-N
• INCHI: 1S/C8H11NO/c1-6-7(9)4-3-5-8(6)10-2/h3-5H,9H2,1-2H3
• Isómeros SMILES: CC1=C(C=CC=C1OC)N
• WGK Alemania: 1
• CAS alternativo: 857195-15-4
• Peso molecular: 137.18
• Beilstein: 13(3)1538
• Reaxy-Rn: 774982
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=774982&ln=

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 Aminotoluenes Alkyl aryl ethers Primary amines Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aminophenyl ether - Methoxyaniline - Anisole - Phenoxy compound - Aniline or substituted anilines - Aminotoluene - Methoxybenzene - Alkyl aryl ether - Toluene - Monocyclic benzene moiety - Ether - Amine - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - 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

Propiedades químicas y físicas

• Sensibilidad: Light Sensitive,Air Sensitive,Heat Sensitive
• Índice de refracción: 1.57
• Punto de inflamación (°F): >230 °F
• Punto de inflamación (°C): >110 °C
• Punto de fusión (°C): 27-28°C
• Peso molecular: 137.180 g/mol
• XLogP3: 2.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 137.084 Da
• Monoisotopic Mass: 137.084 Da
• Topological Polar Surface Area: 35.300 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 105.000
• 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