Cas no 75053-80-4 (Phenol, 4-[3-(trifluoromethyl)phenoxy]-)
![Phenol, 4-[3-(trifluoromethyl)phenoxy]- structure](https://ossimg.kuujia.com/scimg/75500/75053-80-4x500.png)
75053-80-4 structure
Product Name:Phenol, 4-[3-(trifluoromethyl)phenoxy]-
CAS No:75053-80-4
MF:C13H9F3O2
MW:254.204574346542
CID:1776696
PubChem ID:12940614
Update Time:2025-04-21
Phenol, 4-[3-(trifluoromethyl)phenoxy]- Chemical and Physical Properties
Names and Identifiers
-
- Phenol, 4-[3-(trifluoromethyl)phenoxy]-
- SCHEMBL4043144
- 4-(3-Trifluoromethyl-phenoxy)-phenol
- 75053-80-4
- p-(alpha,alpha,alpha-trifluoro-m-tolyloxy)-phenol
- CHEMBL4291469
- DB-087895
- AKOS002678284
-
- Inchi： 1S/C13H9F3O2/c14-13(15,16)9-2-1-3-12(8-9)18-11-6-4-10(17)5-7-11/h1-8,17H
- InChI Key： QBUZGHPDFUNKIZ-UHFFFAOYSA-N
- SMILES： FC(C1C=CC=C(C=1)OC1C=CC(=CC=1)O)(F)F
Computed Properties
- Exact Mass: 254.05547
- Monoisotopic Mass: 254.05546401g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 260
- 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: 4.5
- Topological Polar Surface Area: 29.5?2
Experimental Properties
- PSA: 29.46
Phenol, 4-[3-(trifluoromethyl)phenoxy]- Related Literature
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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
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
75053-80-4 (Phenol, 4-[3-(trifluoromethyl)phenoxy]-) Related Products
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