Cas no 61828-04-4 (1-Phenyl-tricosan)
1-Phenyl-tricosan structure
Product Name:1-Phenyl-tricosan
CAS No:61828-04-4
MF:C29H52
MW:400.723189353943
CID:2026889
PubChem ID:14228592
Update Time:2025-04-21
1-Phenyl-tricosan Chemical and Physical Properties
Names and Identifiers
-
- 1-Phenyl-tricosan
- 1-phenyl-tricosane
- tricosyl-benzene
- tricosylbenzene
- Trikosylbenzol
- 61828-04-4
- DTXSID301316940
-
- Inchi： 1S/C29H52/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23-26-29-27-24-22-25-28-29/h22,24-25,27-28H,2-21,23,26H2,1H3
- InChI Key： MGPABNIRLWRQFF-UHFFFAOYSA-N
- SMILES： C(CCCCCCCCCCC1C=CC=CC=1)CCCCCCCCCCCC
Computed Properties
- Exact Mass: 400.406901659g/mol
- Monoisotopic Mass: 400.406901659g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 29
- Rotatable Bond Count: 22
- Complexity: 288
- 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: 14.7
- Topological Polar Surface Area: 0?2
1-Phenyl-tricosan Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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