Benzophenone - ≥99% , CAS No.119-61-9

CAS: 119-61-9 Cat. No.: B103861 Formula: C₁₃H₁₀O Peso molecolare: 182.22 Beilstein Registry Number: 1238185 Numero EC: 204-337-6

GRADE & PURITY ≥99%

Synonyms

NSC8077 | NSC-8077 | Benzene, benzoyl- | FT-0693251 | BENZOPHENONE (DIPHENYL-KETONE) | Benzophenone (Diphenylmethanone) | Benzophenone, Vetec(TM) reagent grade, 98% | DB01878 | AI3-00754 | EC 204-337-6 | NCGC00090787-06 | NCGC00259974-01 | STL363250 | BE

Storage

Protected from light,Room temperature,Desiccated

Shipped In

Normal

Specifications

Sinonimi

NSC8077 | NSC-8077 | Benzene, benzoyl- | FT-0693251 | BENZOPHENONE (DIPHENYL-KETONE) | Benzophenone (Diphenylmethanone) | Benzophenone, Vetec(TM) reagent grade, 98% | DB01878 | AI3-00754 | EC 204-337-6 | NCGC00090787-06 | NCGC00259974-01 | STL363250 | BE

Specifiche e purezza

≥99%

Condizioni di conservazione di stoccaggio

Protected from light,Room temperature,Desiccated

Spedito in

Normal

Purezza

≥99%

Nomi e identificatori

Pubchem Sid

508812305

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508812305

Sorrisi canonici

C1=CC=C(C=C1)C(=O)C2=CC=CC=C2

IUPAC Name

diphenylmethanone

InChIKey

RWCCWEUUXYIKHB-UHFFFAOYSA-N

INCHI

1S/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H

Isomeri SMILES

C1=CC=C(C=C1)C(=O)C2=CC=CC=C2

WGK Germania

2

RTECS

DI9950000

Numero UN

1224

Gruppo di imballaggio

I

Peso molecolare

182.22

Beilstein

1238185

Reaxy-Rn

1238185

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1238185&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Benzophenones

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Benzophenones
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzophenones
• Alternative Parents: Diphenylmethanes Aryl-phenylketones Benzoyl derivatives Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzophenone - Aryl-phenylketone - Diphenylmethane - Aryl ketone - Benzoyl - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as benzophenones. These are organic compounds containing a ketone attached to two phenyl groups.
• External Descriptors: benzophenones

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

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HepG2 (196354 Activities)

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CCF-STTG1 (114 Activities)

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Obiettivi associati (non umani)

Papain (844 Activities)

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Soluble in methanol
• Sensibilità: Light sensitive.
• Punto di infiammabilità (°F): 280°F
• Punto di infiammabilità (°C): 138 °C - closed cup
• Punto di ebollizione (°C): 305 °C (lit.)
• Punto di fusione (°C): 47-51 °C (lit.)
• Peso molecolare: 182.220 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 182.073 Da
• Monoisotopic Mass: 182.073 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 165.000
• 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