Bis(4-fluorophenyl)phosphine oxide - ≥95% , CAS No.94940-35-9

CAS: 94940-35-9 Cat. No.: B590824 분자식: C₁₂H₉F₂OP 분자량: 238.17 PubChem CID: 13332985

GRADE & PURITY ≥95%

Synonyms

1-fluoro-4-[(4-fluorophenyl)phosphoroso]benzene | bis(4-fluorophenyl)phosphine oxide | DTXSID10537195 | bis(4-fluorophenyl)phosphineoxide | Phosphine oxide, bis(4-fluorophenyl)- | Bis(4-fluorophenyl)(oxo)phosphanium | SCHEMBL1305285 | WMQXKXZCFOGSFU-UHFFF

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

동의어

1-fluoro-4-[(4-fluorophenyl)phosphoroso]benzene | bis(4-fluorophenyl)phosphine oxide | DTXSID10537195 | bis(4-fluorophenyl)phosphineoxide | Phosphine oxide, bis(4-fluorophenyl)- | Bis(4-fluorophenyl)(oxo)phosphanium | SCHEMBL1305285 | WMQXKXZCFOGSFU-UHFFF

사양 및 순도

≥95%

보관 조건

Store at 2-8°C,Protected from light,Argon charged

배송

Wet ice

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순수함

≥95%

이름과 식별자

Pubchem Sid

508812683

정식 스마일

C1=CC(=CC=C1F)[P+](=O)C2=CC=C(C=C2)F

IUPAC Name

bis(4-fluorophenyl)-oxophosphanium

InChIKey

MIYITCTXDGORJJ-UHFFFAOYSA-N

INCHI

1S/C12H8F2OP/c13-9-1-5-11(6-2-9)16(15)12-7-3-10(14)4-8-12/h1-8H/q+1

이성체 SMILES

C1=CC(=CC=C1F)[P+](=O)C2=CC=C(C=C2)F

PubChem CID

13332985

분자량

238.17

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Benzene and substituted derivatives
      • Subclass Halobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Fluorobenzenes
• Alternative Parents: Aryl fluorides Organophosphorus compounds Organofluorides Organic oxides Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Fluorobenzene - Aryl halide - Aryl fluoride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organophosphorus compound - Organofluoride - Organohalogen compound - Organic cation - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene 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

화학 및 물리적 특성

• 분자량: 237.160 g/mol
• XLogP3: 2.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 237.028 Da
• Monoisotopic Mass: 237.028 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 16
• Formal Charge: 1
• Complexity: 219.000
• 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