Cas no 90178-25-9 (Anthracene, 9,10-bis(octadecyloxy)-)
90178-25-9 structure
Product Name:Anthracene, 9,10-bis(octadecyloxy)-
CAS No:90178-25-9
MF:C50H82O2
MW:715.184895992279
CID:792435
PubChem ID:71429846
Update Time:2025-04-19
Anthracene, 9,10-bis(octadecyloxy)- Chemical and Physical Properties
Names and Identifiers
-
- Anthracene, 9,10-bis(octadecyloxy)-
- 9,10-dioctadecoxyanthracene
- 9,10-BIS(OCTADECYLOXY)ANTHRACENE
- 90178-25-9
- DTXSID60848506
-
- Inchi： 1S/C50H82O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-37-43-51-49-45-39-33-35-41-47(45)50(48-42-36-34-40-46(48)49)52-44-38-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33-36,39-42H,3-32,37-38,43-44H2,1-2H3
- InChI Key： DFZKHEUWYTVVNC-UHFFFAOYSA-N
- SMILES： O(C1C2C=CC=CC=2C(=C2C=CC=CC=12)OCCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC
Computed Properties
- Exact Mass: 714.63148185g/mol
- Monoisotopic Mass: 714.63148185g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 52
- Rotatable Bond Count: 36
- Complexity: 665
- 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: 22
- Topological Polar Surface Area: 18.5?2
Anthracene, 9,10-bis(octadecyloxy)- Related Literature
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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