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

CAS: 19500-02-8 Cat. No.: M122543 Summenformel: C₈H₁₁NO Molekulargewicht: 137.18 Beilstein Registry Number: 13(3)1538 EG-Nummer: 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

Synonyme

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

Spezifikationen & Reinheit

≥98%

Storage

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

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 504766744
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504766744
• Kanonisches Lächeln: 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
• Isomere SMILES: CC1=C(C=CC=C1OC)N
• WGK Deutschland: 1
• Alternative CAS-Nummer: 857195-15-4
• Molekulargewicht: 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
    • Klasse Phenol ethers
      • Subclass Aminophenyl ethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: 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
• Beschreibung: 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

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Light Sensitive,Air Sensitive,Heat Sensitive
• Brechungsindex: 1.57
• Flammpunkt (°F): >230 °F
• Flammpunkt (°C): >110 °C
• Schmelzpunkt (°C): 27-28°C
• Molekulargewicht: 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