Cas no 113560-97-7 (4,5,6,7-tetraphenyl-3H-2-benzofuran-1-one)
113560-97-7 structure
Product Name:4,5,6,7-tetraphenyl-3H-2-benzofuran-1-one
CAS No:113560-97-7
MF:C32H22O2
MW:438.515888690948
CID:2611117
PubChem ID:71337459
Update Time:2025-04-21
4,5,6,7-tetraphenyl-3H-2-benzofuran-1-one Chemical and Physical Properties
Names and Identifiers
-
- 4,5,6,7-tetraphenyl-3H-2-benzofuran-1-one
- 4,5,6,7-Tetraphenyl-2-benzofuran-1(3H)-one
- tetraphenylphthalide
- DTXSID20765169
- DTXCID70715912
- 113560-97-7
-
- Inchi： 1S/C32H22O2/c33-32-31-26(21-34-32)27(22-13-5-1-6-14-22)28(23-15-7-2-8-16-23)29(24-17-9-3-10-18-24)30(31)25-19-11-4-12-20-25/h1-20H,21H2
- InChI Key： XASKKQPVPIMSRV-UHFFFAOYSA-N
- SMILES： O1C(C2=C(C3C=CC=CC=3)C(C3C=CC=CC=3)=C(C3C=CC=CC=3)C(C3C=CC=CC=3)=C2C1)=O
Computed Properties
- Exact Mass: 438.161979940Da
- Monoisotopic Mass: 438.161979940Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 34
- Rotatable Bond Count: 4
- Complexity: 662
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 7.9
- Topological Polar Surface Area: 26.3?2
4,5,6,7-tetraphenyl-3H-2-benzofuran-1-one Related Literature
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
-
Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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