4-(Bromomethyl)benzophenone - ≥96%(HPLC) , CAS No.32752-54-8

CAS: 32752-54-8 Cat. No.: B152127 Summenformel: C₁₄H₁₁BrO Molekulargewicht: 275.15 EG-Nummer: 251-197-7

GRADE & PURITY ≥96%(HPLC)

Synonyms

A23H9ZH86Z | 1yfz | 4-Bromomethylbenzophenone | alpha-bromo-4-benzoyl toluene | AS-18298 | DIDANOSINE IMPURITY A | J-018864 | SY052503 | [4-(Bromomethyl)phenyl](phenyl)methanone | alpha-bromo-p-benzoyl toluene | IDI1_007936 | CHEBI:17596 | Enamine_005701

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyme

A23H9ZH86Z | 1yfz | 4-Bromomethylbenzophenone | alpha-bromo-4-benzoyl toluene | AS-18298 | DIDANOSINE IMPURITY A | J-018864 | SY052503 | [4-(Bromomethyl)phenyl](phenyl)methanone | alpha-bromo-p-benzoyl toluene | IDI1_007936 | CHEBI:17596 | Enamine_005701

Spezifikationen & Reinheit

≥96%(HPLC)

Storage

Store at 2-8°C,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥96%(HPLC)

Namen und Kennungen

Pubchem Sid

508809299

Kanonisches Lächeln

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

IUPAC Name

[4-(bromomethyl)phenyl]-phenylmethanone

InChIKey

RYULULVJWLRDQH-UHFFFAOYSA-N

INCHI

1S/C14H11BrO/c15-10-11-6-8-13(9-7-11)14(16)12-4-2-1-3-5-12/h1-9H,10H2

Isomere SMILES

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

WGK Deutschland

3

Molekulargewicht

275.15

Reaxy-Rn

641196

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=641196&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Benzophenones
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzophenones
• Alternative Parents: Diphenylmethanes Aryl-phenylketones Benzyl bromides Benzoyl derivatives Organobromides Organic oxides Hydrocarbon derivatives Alkyl bromides
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzophenone - Diphenylmethane - Aryl-phenylketone - Benzoyl - Aryl ketone - Benzyl bromide - Benzyl halide - Ketone - Organooxygen compound - Organobromide - Organohalogen compound - Organic oxide - Alkyl bromide - Alkyl halide - Organic oxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Beschreibung: 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: 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

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Moisture sensitive
• Schmelzpunkt (°C): 112℃
• Molekulargewicht: 275.140 g/mol
• XLogP3: 3.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 273.999 Da
• Monoisotopic Mass: 273.999 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 225.000
• 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