2,5-Dimethoxyaniline - ≥97% , CAS No.102-56-7

CAS: 102-56-7 Cat. No.: D111647 Peso molecular: 153.18 Beilstein Registry Number: 776823 Número EC: 203-040-9

GRADE & PURITY ≥97%

Synonyms

Aniline, 2,5-dimethoxy- | SMR000063286 | 2,5-Dimethoxybenzenamine | SCHEMBL92071 | D1893 | PS-3249 | Benzenamine, 2,5-dimethoxy- | BRN 0776823 | WLN: 1OR BZ DO1 | BDBM55250 | V3Z5U3FL10 | EN300-33970 | MLS000053359 | (2,5-dimethoxyphenyl)amine;hydrochlori

Storage

Protected from light,Argon charged,Room temperature

Shipped In

Normal

Descripción general

2,5-Dimethoxyaniline is used as a laccase inducer which immobilizes the enzyme laccase from Trumetes versicolor. 2,5-Dimethoxyaniline is used for the electrochemical copolymerization of diphenylamine in 4M sulfuric acid.

Specifications

Sinónimos

Aniline, 2, 5-dimethoxy- | SMR000063286 | 2, 5-Dimethoxybenzenamine | SCHEMBL92071 | D1893 | PS-3249 | Benzenamine, 2, 5-dimethoxy- | BRN 0776823 | WLN: 1OR BZ DO1 | BDBM55250 | V3Z5U3FL10 | EN300-33970 | MLS000053359 | (2, 5-dimethoxyphenyl)amine;hydrochlori

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Protected from light, Argon charged, Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 504751407
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504751407
• Sonrisas canónicas: COC1=CC(=C(C=C1)OC)N
• IUPAC Name: 2,5-dimethoxyaniline
• InChIKey: NAZDVUBIEPVUKE-UHFFFAOYSA-N
• INCHI: 1S/C8H11NO2/c1-10-6-3-4-8(11-2)7(9)5-6/h3-5H,9H2,1-2H3
• Isómeros SMILES: COC1=CC(=C(C=C1)OC)N
• WGK Alemania: 1
• RTECS: BX4375000
• Número ONU: 2811
• Peso molecular: 153.18
• Beilstein: 776823
• Reaxy-Rn: 776823
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=776823&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Methoxybenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Methoxybenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Dimethoxybenzenes
• Alternative Parents: Methoxyanilines Aminophenyl ethers Phenoxy compounds Anisoles Alkyl aryl ethers Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: P-dimethoxybenzene - Dimethoxybenzene - Aminophenyl ether - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Aniline or substituted anilines - Alkyl aryl ether - Ether - Primary amine - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.
• 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

• Solubilidad: Soluble in water, ethanol, methanol, heat ligroin.
• Sensibilidad: Light sensitive. air sensitive
• Punto de inflamación (°F): 266 °F
• Punto de inflamación (°C): 130℃
• Punto de ebullición (°C): 270°C
• Punto de fusión (°C): 79-81°C
• Peso molecular: 153.180 g/mol
• XLogP3: 1.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 153.079 Da
• Monoisotopic Mass: 153.079 Da
• Topological Polar Surface Area: 44.500 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 119.000
• 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

Referencias

1. Yuxiao Chu, Yuxin Yang, Haihui Lin, Zilong Zhang, Shilong Chang, Cuihong Zhang, Peng Zhang, Lei Dong, Fu-Gang Zhao, Xiao-Jin Wu, Jian Chen, Yongmiao Shen.  (2024)  Heterogeneous polymer of aniline and benzoquinone enabled high energy density of graphene-based supercapacitors.  Journal of Energy Storage,      [PMID:] [10.1016/j.est.2024.112906]

2. Yuxin Yang, Shilong Chang, Jialei Bao, Lei Dong, Yongmiao Shen, Fu-Gang Zhao.  (2025)  Organic functionalization upgrading ordinary adsorption-type activated carbon for high-performance supercapacitors.  JOURNAL OF ALLOYS AND COMPOUNDS,      [PMID:] [10.1016/j.jallcom.2025.181323]