2,4,6-Triméthoxyaniline - ≥98% , CAS No.14227-17-9

CAS: 14227-17-9 Cat. No.: T190885 Formule: C₉H₁₃NO₃ Poids moléculaire: 183.2 Numéro CE: 238-095-8 PubChem CID: 84271

QUALITÉ & PURETÉ ≥98%

Synonyms

AKOS000140047 | DTXSID70161990 | SCHEMBL1122691 | 2,4,6-Trimethoxyaniline | 2,4,6-tri-methoxyaniline | (2,4,6-trimethoxy-phenyl)-amine | EN300-176234 | W-205571 | EINECS 238-095-8 | FT-0748636 | A885205 | FNSAKXLEFPFZOM-UHFFFAOYSA-N | MFCD00017165 | 2,4,6

Storage

Stocker à 2-8°C, chargé d'argon

Shipped In

Glace humide

Spécifications

Synonymes

AKOS000140047 | DTXSID70161990 | SCHEMBL1122691 | 2,4,6-Trimethoxyaniline | 2,4,6-tri-methoxyaniline | (2,4,6-trimethoxy-phenyl)-amine | EN300-176234 | W-205571 | EINECS 238-095-8 | FT-0748636 | A885205 | FNSAKXLEFPFZOM-UHFFFAOYSA-N | MFCD00017165 | 2,4,6

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Stocker à 2-8°C, chargé d'argon

Expédié en

Glace humide

Pureté

≥98%

Noms et identifiants

Pubchem Sid

528755384

Sourires canoniques

COC1=CC(=C(C(=C1)OC)N)OC

IUPAC Name

2,4,6-trimethoxyaniline

InChIKey

FNSAKXLEFPFZOM-UHFFFAOYSA-N

INCHI

1S/C9H13NO3/c1-11-6-4-7(12-2)9(10)8(5-6)13-3/h4-5H,10H2,1-3H3

Isomères SMILES

COC1=CC(=C(C(=C1)OC)N)OC

PubChem CID

84271

Poids moléculaire

183.2

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 Alkyl aryl ethers 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 - Organopnictogen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Amine - 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

• Poids moléculaire: 183.200 g/mol
• XLogP3: 1.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 183.09 Da
• Monoisotopic Mass: 183.09 Da
• Topological Polar Surface Area: 53.700 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 140.000
• 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