2,2'-Dihydroxybenzophenone - ≥98% , CAS No.835-11-0

CAS: 835-11-0 Cat. No.: D154786 Fórmula: C₁₃H₁₀O₃ Peso molecular: 214.22 Beilstein Registry Number: 8313 Número CE: 212-639-4

GRADE & PURITY ≥98%

Synonyms

2,2'-dihydroxybenzophenone | 2,2-DIHYDROXYBENZOPHENONE | BIDD:ER0637 | SCHEMBL18422 | AKOS015856204 | Methanone, bis(2-hydroxyphenyl)- | D1099 | 2,2'-dihydroxy benzophenone | 2,2'-DIHYDROXYBENZPHENONE | BDBM50060862 | CAS-835-11-0 | NCGC00248943-01 | 2.2/

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

2,2'-dihydroxybenzophenone | 2,2-DIHYDROXYBENZOPHENONE | BIDD:ER0637 | SCHEMBL18422 | AKOS015856204 | Methanone, bis(2-hydroxyphenyl)- | D1099 | 2,2'-dihydroxy benzophenone | 2,2'-DIHYDROXYBENZPHENONE | BDBM50060862 | CAS-835-11-0 | NCGC00248943-01 | 2.2/

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥98%

Nomes e identificadores

• Pubchem Sid: 504754479
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504754479
• Sorrisos canónicos: C1=CC=C(C(=C1)C(=O)C2=CC=CC=C2O)O
• IUPAC Name: bis(2-hydroxyphenyl)methanone
• InChIKey: YIYBRXKMQFDHSM-UHFFFAOYSA-N
• INCHI: 1S/C13H10O3/c14-11-7-3-1-5-9(11)13(16)10-6-2-4-8-12(10)15/h1-8,14-15H
• SMILES isoméricas: C1=CC=C(C(=C1)C(=O)C2=CC=CC=C2O)O
• WGK Alemanha: 3
• Peso molecular: 214.22
• Beilstein: 8313
• Reaxy-Rn: 1912111
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1912111&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 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Vinylogous acids Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzophenone - Aryl-phenylketone - Diphenylmethane - Aryl ketone - Benzoyl - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Vinylogous acid - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
• Descrição: 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

Alvos associados (humanos)

ALOX5 Tclin Arachidonate 5-lipoxygenase (6568 Activities)

Discover Target: ALOX5

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

GSTA1 Tchem Glutathione S-transferase A1 (120 Activities)

Discover Target: GSTA1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Alvos associados (não humanos)

Mus musculus (284745 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de ação

Propriedades químicas e físicas

• Sensibilidade: light sensitive
• Ponto de fusão (°C): 61-62.5 °C
• Peso molecular: 214.220 g/mol
• XLogP3: 3.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 214.063 Da
• Monoisotopic Mass: 214.063 Da
• Topological Polar Surface Area: 57.500 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 228.000
• 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

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 835-11-0, the molecular formula is C13H10O3, and the molecular weight is 214.22 g/mol. InChIKey YIYBRXKMQFDHSM-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.