Fenazaquin - analytical standard , CAS No.120928-09-8

CAS: 120928-09-8 Cat. No.: F114674 Peso molecular: 306.4 Beilstein Registry Number: 8331263 Número EC: 410-580-0

GRADE & PURITY Analytical standard

Synonyms

4-[2-(4-tert-butylphenyl)ethoxy]quinazoline | Benzoic acid, 4-amino-, monosodium salt | J-004412 | Fenazaquin 10 microg/mL in Acetonitrile | Q1404580 | A906814 | CAS-120928-09-8 | AKOS015903772 | DK5Q534WEE | Quinazoline, 4-((4-(1,1-dimethylethyl)phenyl)e

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

4-[2-(4-tert-butylphenyl)ethoxy]quinazoline | Benzoic acid, 4-amino-, monosodium salt | J-004412 | Fenazaquin 10 microg/mL in Acetonitrile | Q1404580 | A906814 | CAS-120928-09-8 | AKOS015903772 | DK5Q534WEE | Quinazoline, 4-((4-(1, 1-dimethylethyl)phenyl)e

Especificaciones y pureza

analytical standard

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Grado

Analytical standard

Tipo de acción

INHIBITOR

Nombres e identificadores

• Sonrisas canónicas: CC(C)(C)C1=CC=C(C=C1)CCOC2=NC=NC3=CC=CC=C32
• IUPAC Name: 4-[2-(4-tert-butylphenyl)ethoxy]quinazoline
• InChIKey: DMYHGDXADUDKCQ-UHFFFAOYSA-N
• INCHI: 1S/C20H22N2O/c1-20(2,3)16-10-8-15(9-11-16)12-13-23-19-17-6-4-5-7-18(17)21-14-22-19/h4-11,14H,12-13H2,1-3H3
• Isómeros SMILES: CC(C)(C)C1=CC=C(C=C1)CCOC2=NC=NC3=CC=CC=C32
• WGK Alemania: 3
• RTECS: VA1382000
• Número ONU: 2811
• Peso molecular: 306.4
• Beilstein: 8331263
• Reaxy-Rn: 8331263
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8331263&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Diazanaphthalenes
      • Subclass Benzodiazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Diazanaphthalenes
• Subclass: Benzodiazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Quinazolines
• Alternative Parents: Phenylpropanes Alkyl aryl ethers Pyrimidines and pyrimidine derivatives Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Quinazoline - Phenylpropane - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Pyrimidine - Heteroaromatic compound - Ether - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
• Descripción: This compound belongs to the class of organic compounds known as quinazolines. These are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine ring.
• External Descriptors: Acaricides

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

Objetivos asociados (no humanos)

Apis mellifera (12 Activities)

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Tetranychus urticae (2600 Activities)

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Mecanismos de acción

Propiedades químicas y físicas

• Punto de fusión (°C): 70-71°C
• Peso molecular: 306.400 g/mol
• XLogP3: 5.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 306.173 Da
• Monoisotopic Mass: 306.173 Da
• Topological Polar Surface Area: 35.000 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 357.000
• 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. Feng He, Aihong Wu, Chuanlai Xu, Hua Kuang, Aihua Qu.  (2026)  A Sensitive and Specific Dual-T-Line Immunochromatographic Assay Based on Rational Hapten Design for On-Site Rapid Detection of Fenazaquin in Food and Environmental Samples.  JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY,      [PMID:41493823] [10.1021/acs.jafc.5c14481]