5,6-dimethyl-1,3-di...

5,6-dimethyl-1,3-diphenyl-4,7-dihydroisobenzofuran 5452-32-4

5,6-dimethyl-1,3-diphenyl-4,7-dihydroisobenzofuran 5452-32-4

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  • Min.Order :1 Gram
  • Purity: 99%
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5,6-dimethyl-1,3-diphenyl-4,7-dihydroisobenzofuran 5452-32-4 98%

Quick Details

  • Appearance:Solid
  • Application:Organic Chemicals
  • PackAge:as requested
  • ProductionCapacity:1|Metric Ton|Month
  • Storage:room temperature
  • Transportation:By sea or by air

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Details:

【Name】
5,6-dimethyl-1,3-diphenyl-4,7-dihydro-2-benzofuran
【CAS Registry number】
5452-32-4
【Synonyms】
5,6-dimethyl-1,3-diphenyl-4,7-dihydro-2-benzofuran
NSC18959
AC1L5FGN
AC1Q6ZE8
AR-1G6218
NSC-18959
【Molecular Formula】
C22H20O (Products with the same molecular formula)
【Molecular Weight】
300.3936
【Inchi】
InChI=1/C22H20O/c1-15-13-19-20(14-16(15)2)22(18-11-7-4-8-12-18)23-21(19)17-9-5-3-6-10-17/h3-12H,13-14H2,1-2H3
【Canonical SMILES】
CC1=C(CC2=C(OC(=C2C1)C3=CC=CC=C3)C4=CC=CC=C4)C
【MOL File】
5452-32-4.mol
Chemical and Physical Properties
【Density】
1.077g/cm3
【Boiling Point】
454.6°C at 760 mmHg
【Refractive Index】
1.585
【Flash Point】
234.7°C
【Computed Properties】
Molecular Weight:300.3936 [g/mol]
Molecular Formula:C22H20O
XLogP3-AA:5.2
H-Bond Donor:0
H-Bond Acceptor:1
Rotatable Bond Count:2
Exact Mass:300.151415
MonoIsotopic Mass:300.151415
Topological Polar Surface Area:13.1
Heavy Atom Count:23
Formal Charge:0
Complexity:399
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Ring Count:4
Effective Rotor Count:2.4
Conformer Sampling RMSD:0.6
CID Conformer Count:2

 

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