2-Phenylhydroquinone - ≥97% , CAS No.1079-21-6

CAS: 1079-21-6 Cat. No.: P102216 Fórmula: C₁₂H₁₀O₂ Peso molecular: 186.21 Beilstein Registry Number: 1949429 Número EC: 214-091-1

GRADE & PURITY ≥97%

Synonyms

2-Phenyl-1,4-benzenediol | K3C | 2-Phenylhydroquinone | GPT41T80FJ | AC-26579 | BRN 1949429 | Biphenyl-2,5-diol | SCHEMBL68984 | O-Phenylhydroquinone | 2-PHENYL-1,4-HYDROQUINONE | AI3-19362 | D0584 | 1,4-dihydroxy-2-phenylbenzene | DTXSID7051553 | 1, phen

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinónimos

2-Phenyl-1,4-benzenediol | K3C | 2-Phenylhydroquinone | GPT41T80FJ | AC-26579 | BRN 1949429 | Biphenyl-2,5-diol | SCHEMBL68984 | O-Phenylhydroquinone | 2-PHENYL-1,4-HYDROQUINONE | AI3-19362 | D0584 | 1,4-dihydroxy-2-phenylbenzene | DTXSID7051553 | 1, phen

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Room temperature,Argon charged

Enviado en

Normal

Tipo de acción

ACTIVATOR

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 488181946
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488181946
• Sonrisas canónicas: C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O
• IUPAC Name: 2-phenylbenzene-1,4-diol
• InChIKey: XCZKKZXWDBOGPA-UHFFFAOYSA-N
• INCHI: 1S/C12H10O2/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,13-14H
• Isómeros SMILES: C1=CC=C(C=C1)C2=C(C=CC(=C2)O)O
• WGK Alemania: 3
• RTECS: DV4550000
• Peso molecular: 186.21
• Beilstein: 1949429
• Reaxy-Rn: 1949429
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1949429&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Biphenyls and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Biphenyls and derivatives
• Alternative Parents: Hydroquinones 1-hydroxy-2-unsubstituted benzenoids Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Biphenyl - Hydroquinone - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as biphenyls and derivatives. These are organic compounds containing to benzene rings linked together by a C-C bond.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Sensibilidad: Light Sensitive;Air Sensitive;Moisture sensitive
• Punto de fusión (°C): 98-100°C
• Peso molecular: 186.210 g/mol
• XLogP3: 3.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 186.068 Da
• Monoisotopic Mass: 186.068 Da
• Topological Polar Surface Area: 40.500 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 175.000
• 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. Tianwen Yan, Fei Yan, Shiyi Li, Ming Li, Yu Liu, Mengjie Zhang, Lin Jin, Lei Shang, Liu Liu, Yuhui Ao.  (2020)  Interfacial enhancement of CF/PEEK composites by modifying water-based PEEK-NH2 sizing agent.  COMPOSITES PART B-ENGINEERING,      [PMID:] [10.1016/j.compositesb.2020.108258]