9,9-Dimethylxanthene - ≥97% , CAS No.19814-75-6

CAS: 19814-75-6 Cat. No.: D111430 Fórmula: C₁₅H₁₄O Peso molecular: 210.27 Número CE: 803-050-9

GRAU & PUREZA ≥97%

Synonyms

(6aR,9R)-5-bromo-N-((2R,5S,10aS,10bS)-|9,9-dimethylxanthene;9,9-Dimethyl-9H-xanthene|9,9-Dimethylxanthene|9,9-Dimethylxantene|9H-Xanthene, 9,9-dimethyl-|9,9-Dimethyl-9H-xanthene|9,9-Dimethyl-9H-xanthene #|9,9-Dimethyl-9H-xanthene (purified by sublimation)|Xanthene, 9,9-dimethyl-

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Visão geral

9,9-Dimethylxanthene is a heterocyclic building block.
9,9-Dimethylxanthene is suitable for use in the preparation of 9,9-dimethylxanthene-4,5-dicarboxylic acid.It may be used in the preparation of 9,9-dimethyl-4,5-bis(diphenylphosphino)xanthene.It may be used in the preparation of 4,6-bis(dimesitylboryl)dibenzofuran.

Especificações

Sinónimos

(6aR,9R)-5-bromo-N-((2R,5S,10aS,10bS)- | 9,9-dimethylxanthene;9,9-Dimethyl-9H-xanthene | 9,9-Dimethylxanthene | 9,9-Dimethylxantene | 9H-Xanthene, 9,9-dimethyl- | 9,9-Dimethyl-9H-xanthene | 9,9-Dimethyl-9H-xanthene # | 9,9-Dimethyl-9H-xanthene (purified by sublimation) | Xanthene, 9,9-dimethyl-

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Store at 2-8°C,Argon charged

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥97%

Nomes e identificadores

Pubchem Sid

504759509

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504759509

Sorrisos canónicos

CC1(C2=CC=CC=C2OC3=CC=CC=C31)C

IUPAC Name

9,9-dimethylxanthene

InChIKey

MTVNAPYHLASOSX-UHFFFAOYSA-N

INCHI

1S/C15H14O/c1-15(2)11-7-3-5-9-13(11)16-14-10-6-4-8-12(14)15/h3-10H,1-2H3

SMILES isoméricas

CC1(C2=CC=CC=C2OC3=CC=CC=C31)C

WGK Alemanha

3

Peso molecular

210.27

Reaxy-Rn

1310739

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1310739&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Benzopyrans
      • Subclass 1-benzopyrans
        • Level5 Dibenzopyrans
          • Level6 Xanthenes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Benzopyrans
• Subclass: 1-benzopyrans
• Intermediate Tree Nodes: Dibenzopyrans
• Direct Parent: Xanthenes
• Alternative Parents: Diarylethers Benzenoids Oxacyclic compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Xanthene - Diaryl ether - Benzenoid - Oxacycle - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as xanthenes. These are polycyclic aromatic compounds containing a xanthene moiety, which consists of two benzene rings joined to each other by a pyran ring.
• 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

Propriedades químicas e físicas

• Solubilidade: Insoluble in water
• Sensibilidade: air sensitive
• Índice de refração: 1.6
• Ponto de inflamação (°F): 235.4 °F
• Ponto de inflamação (°C): 113 °C
• Ponto de ebulição (°C): 115 °C/0.6 mmHg
• Ponto de fusão (°C): 38 °C
• Peso molecular: 210.270 g/mol
• XLogP3: 4.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 210.104 Da
• Monoisotopic Mass: 210.104 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 234.000
• 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