Cas no 114175-93-8 (Benzene,1-[(trans,trans)-4'-ethyl[1,1'-bicyclohexyl]-4-yl]-4-fluoro-)
![Benzene,1-[(trans,trans)-4'-ethyl[1,1'-bicyclohexyl]-4-yl]-4-fluoro- structure](https://ossimg.kuujia.com/scimg/114500/114175-93-8x500.png)
114175-93-8 structure
Product Name:Benzene,1-[(trans,trans)-4'-ethyl[1,1'-bicyclohexyl]-4-yl]-4-fluoro-
CAS No:114175-93-8
MF:C20H29F
MW:288.442669630051
CID:105758
PubChem ID:18605132
Update Time:2025-04-18
Benzene,1-[(trans,trans)-4'-ethyl[1,1'-bicyclohexyl]-4-yl]-4-fluoro- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1-[(trans,trans)-4'-ethyl[1,1'-bicyclohexyl]-4-yl]-4-fluoro-
- 4-ethyl-4'-(4-fluorophenyl)-1,1'-bi(cyclohexyl)
- 1-[(trans,trans)-4'-Ethyl[1,1'-bicyclohexyl]-4-yl]-4-fluorobenzene
- Benzene,1-[(trans,trans)-4'-ethyl[1,1'-bicyclohexyl]-4-yl]-4-fluoro- (Related Reference)
- 114175-93-8
- SCHEMBL9346197
- AKOS015917976
- FT-0753019
- SCHEMBL9346227
- SCHEMBL9346214
- SCHEMBL9346208
- 1-[4-(4-ethylcyclohexyl)cyclohexyl]-4-fluorobenzene
- 4-ethyl-4'-(4-fluorophenyl)bi(cyclohexane)
- SCHEMBL13433679
-
- Inchi： 1S/C20H29F/c1-2-15-3-5-16(6-4-15)17-7-9-18(10-8-17)19-11-13-20(21)14-12-19/h11-18H,2-10H2,1H3
- InChI Key： KSXLYSKMTFFAND-UHFFFAOYSA-N
- SMILES： FC1C=CC(=CC=1)C1CCC(CC1)C1CCC(CC)CC1
Computed Properties
- Exact Mass: 288.22547
- Monoisotopic Mass: 288.225329087g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 21
- Rotatable Bond Count: 3
- Complexity: 289
- 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: 7.8
- Topological Polar Surface Area: 0?2
Experimental Properties
- Density: 0.986±0.06 g/cm3 (20 oC 760 Torr),
- Boiling Point: 373.9°C at 760 mmHg
- Flash Point: 169°C
- Refractive Index: 1.507
- Solubility: Insuluble (4.6E-6 g/L) (25 oC),
- PSA: 0
- LogP: 6.31590
Benzene,1-[(trans,trans)-4'-ethyl[1,1'-bicyclohexyl]-4-yl]-4-fluoro- Related Literature
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
-
Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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