Cas no 252852-44-1 (Benzene,1-[(trans,trans)-4'-ethyl[1,1'-bicyclohexyl]-4-yl]-3,5-difluoro-)
![Benzene,1-[(trans,trans)-4'-ethyl[1,1'-bicyclohexyl]-4-yl]-3,5-difluoro- structure](https://ossimg.kuujia.com/scimg/253000/252852-44-1x500.png)
252852-44-1 structure
Product Name:Benzene,1-[(trans,trans)-4'-ethyl[1,1'-bicyclohexyl]-4-yl]-3,5-difluoro-
CAS No:252852-44-1
MF:C20H28F2
MW:306.433133125305
CID:246563
PubChem ID:53447371
Update Time:2025-04-19
Benzene,1-[(trans,trans)-4'-ethyl[1,1'-bicyclohexyl]-4-yl]-3,5-difluoro- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1-[(trans,trans)-4'-ethyl[1,1'-bicyclohexyl]-4-yl]-3,5-difluoro-
- 1-[4-(4-ethylcyclohexyl)cyclohexyl]-3,5-difluorobenzene
- 4-(3,5-Difluorophenyl)-4'-ethyl-1,1'-bi(cyclohexyl)
- benzene, 1-(4'-ethyl[1,1'-bicyclohexyl]-4-yl)-3,5-difluoro-
- LogP
- DTXSID20703440
- 252852-44-1
- 1~4~-Ethyl-3~3~,3~5~-difluoro-1~1~,1~2~,1~3~,1~4~,1~5~,1~6~,2~1~,2~2~,2~3~,2~4~,2~5~,2~6~-dodecahydro-1~1~,2~1~:2~4~,3~1~-terphenyl
-
- Inchi： 1S/C20H28F2/c1-2-14-3-5-15(6-4-14)16-7-9-17(10-8-16)18-11-19(21)13-20(22)12-18/h11-17H,2-10H2,1H3
- InChI Key： CRUMPIZCOQDADR-UHFFFAOYSA-N
- SMILES： FC1C=C(C=C(C=1)C1CCC(CC1)C1CCC(CC)CC1)F
Computed Properties
- Exact Mass: 306.21604
- Monoisotopic Mass: 306.216
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 22
- Rotatable Bond Count: 3
- Complexity: 317
- 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
- Topological Polar Surface Area: 0A^2
- XLogP3: 7.9
Experimental Properties
- Density: 1.032
- Boiling Point: 364.9°C at 760 mmHg
- Flash Point: 146.9°C
- Refractive Index: 1.499
- PSA: 0
Benzene,1-[(trans,trans)-4'-ethyl[1,1'-bicyclohexyl]-4-yl]-3,5-difluoro- Related Literature
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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