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

CAS: 19500-02-8 Cat. No.: M122543 Formule: C₈H₁₁NO Poids moléculaire: 137.18 Beilstein Registry Number: 13(3)1538 Numéro CE: 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

Synonymes

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

Spécifications et pureté

≥98%

Conditions de stockage de stockage

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

Expédié en

Wet ice

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

Pureté

≥98%

Noms et identifiants

• Pubchem Sid: 504766744
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504766744
• Sourires canoniques: 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
• Isomères SMILES: CC1=C(C=CC=C1OC)N
• WGK Allemagne: 1
• CAS alternatif: 857195-15-4
• Poids moléculaire: 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
    • Classe Phenol ethers
      • Subclass Aminophenyl ethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: 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
• Description: 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

Propriétés chimiques et physiques

• Sensibilité: Light Sensitive,Air Sensitive,Heat Sensitive
• Indice de réfraction: 1.57
• Point d'éclair (°F): >230 °F
• Point d'éclair (°C): >110 °C
• Point de fusion (°C): 27-28°C
• Poids moléculaire: 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