Cas no 805252-97-5 (Anthracene, 2,2'-(1,4-phenylene)bis[9,10-diphenyl-)
805252-97-5 structure
Product Name:Anthracene, 2,2'-(1,4-phenylene)bis[9,10-diphenyl-
CAS No:805252-97-5
MF:C58H38
MW:734.922335147858
CID:1801597
PubChem ID:57675916
Update Time:2025-04-21
Anthracene, 2,2'-(1,4-phenylene)bis[9,10-diphenyl- Chemical and Physical Properties
Names and Identifiers
-
- Anthracene, 2,2'-(1,4-phenylene)bis[9,10-diphenyl-
- 1,4-Bis(9,10-diphenylanthracen-2-yl)benzene
- HS-8157
- 805252-97-5
- 2-[4-(9,10-diphenylanthracen-2-yl)phenyl]-9,10-diphenylanthracene
-
- Inchi: 1S/C58H38/c1-5-17-41(18-6-1)55-47-25-13-15-27-49(47)57(43-21-9-3-10-22-43)53-37-45(33-35-51(53)55)39-29-31-40(32-30-39)46-34-36-52-54(38-46)58(44-23-11-4-12-24-44)50-28-16-14-26-48(50)56(52)42-19-7-2-8-20-42/h1-38H
- InChI Key: RLJLSISFHCWHKO-UHFFFAOYSA-N
- SMILES: C12=CC(=CC=C1C(C1C=CC=CC=1)=C1C=CC=CC1=C2C1C=CC=CC=1)C1C=CC(=CC=1)C1=CC=C2C(C3C=CC=CC=3)=C3C=CC=CC3=C(C3C=CC=CC=3)C2=C1
Computed Properties
- Exact Mass: 734.297351212g/mol
- Monoisotopic Mass: 734.297351212g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 58
- Rotatable Bond Count: 6
- Complexity: 1170
- 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: 16.7
- Topological Polar Surface Area: 0?2
Anthracene, 2,2'-(1,4-phenylene)bis[9,10-diphenyl- Related Literature
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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