3,5-diphenyl-5H-fur...

3,5-diphenyl-5H-furan-2-one 5369-56-2

3,5-diphenyl-5H-furan-2-one 5369-56-2

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3,5-diphenyl-5H-furan-2-one 5369-56-2 C16H12O2

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  • Appearance:Solid
  • Application:Organic Chemicals
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  • ProductionCapacity:100|Kilogram|Month
  • Storage:room temperature
  • Transportation:as requested

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Details:

Identification and Related Records
【Name】
3,5-diphenylfuran-2(5H)-one
【Iupac name】
2,4-diphenyl-2H-furan-5-one
【CAS Registry number】
5369-56-2
【Synonyms】
NSC255266
AC1L7YDG
2,4-diphenyl-2H-furan-5-one
NSC-255266
5369-56-2
【Molecular Formula】
C16H12O2 (Products with the same molecular formula)
【Molecular Weight】
236.2653
【Inchi】
InChI=1/C16H12O2/c17-16-14(12-7-3-1-4-8-12)11-15(18-16)13-9-5-2-6-10-13/h1-11,15H
【Canonical SMILES】
C1=CC=C(C=C1)C2C=C(C(=O)O2)C3=CC=CC=C3
【MOL File】
5369-56-2.mol
Chemical and Physical Properties
【Density】
1.206g/cm3
【Boiling Point】
453.1°C at 760 mmHg
【Refractive Index】
1.618
【Flash Point】
191.8°C
【Computed Properties】
Molecular Weight:236.26528 [g/mol]
Molecular Formula:C16H12O2
XLogP3-AA:3.6
H-Bond Donor:0
H-Bond Acceptor:2
Rotatable Bond Count:2
Exact Mass:236.08373
MonoIsotopic Mass:236.08373
Topological Polar Surface Area:26.3
Heavy Atom Count:18
Formal Charge:0
Complexity:333
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:1
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Ring Count:3
Effective Rotor Count:2.4
Conformer Sampling RMSD:0.6
CID Conformer Count:4

 

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