4-Iodobenzophenone - ≥95% , CAS No.6136-66-9

CAS: 6136-66-9 Cat. No.: I342674 Formula: C₁₃H₉OI Peso molecolare: 308.11 Numero EC: 674-186-2

GRADE & PURITY ≥95%

Synonyms

4-Iodobenzophenone | FS-4721 | (4-iodophenyl)phenylmethanone | (4-iodophenyl)-phenylmethanone | C75875 | Methanone, (4-iodophenyl)phenyl- | p-Iodobenzophenone | (4-Iodophenyl)(phenyl)methanone # | AKOS009338000 | DTXSID10341057 | 4-Jodbenzophenon | (4-Iod

Storage

Protected from light,Room temperature

Shipped In

Normal

Specifications

Sinonimi

4-Iodobenzophenone | FS-4721 | (4-iodophenyl)phenylmethanone | (4-iodophenyl)-phenylmethanone | C75875 | Methanone, (4-iodophenyl)phenyl- | p-Iodobenzophenone | (4-Iodophenyl)(phenyl)methanone # | AKOS009338000 | DTXSID10341057 | 4-Jodbenzophenon | (4-Iod

Specifiche e purezza

≥95%

Condizioni di conservazione di stoccaggio

Protected from light,Room temperature

Spedito in

Normal

Purezza

≥95%

Nomi e identificatori

• Pubchem Sid: 528760919
• Sorrisi canonici: C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)I
• IUPAC Name: (4-iodophenyl)-phenylmethanone
• InChIKey: OCAJMURFVZWFPX-UHFFFAOYSA-N
• INCHI: 1S/C13H9IO/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9H
• Isomeri SMILES: C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)I
• Peso molecolare: 308.11
• Reaxy-Rn: 2414621
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2414621&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 Iodobenzenes Aryl iodides Organoiodides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzophenone - Diphenylmethane - Aryl-phenylketone - Benzoyl - Aryl ketone - Iodobenzene - Halobenzene - Aryl iodide - Aryl halide - Ketone - Organooxygen compound - Organoiodide - Organohalogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - 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: 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

Proprietà chimiche e fisiche

• Sensibilità: light sensitive
• Peso molecolare: 308.110 g/mol
• XLogP3: 4.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 307.97 Da
• Monoisotopic Mass: 307.97 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 15
• Formal Charge: 0
• Complexity: 213.000
• 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