Cas no 680593-95-7 (2-{[5-(Trifluoromethyl)-2-pyridyl]oxy}acetonitrile)
![2-{[5-(Trifluoromethyl)-2-pyridyl]oxy}acetonitrile structure](https://ossimg.kuujia.com/scimg/681000/680593-95-7x500.png)
680593-95-7 structure
Product Name:2-{[5-(Trifluoromethyl)-2-pyridyl]oxy}acetonitrile
CAS No:680593-95-7
MF:C8H5F3N2O
MW:202.133311986923
CID:841455
PubChem ID:2809223
Update Time:2025-04-19
2-{[5-(Trifluoromethyl)-2-pyridyl]oxy}acetonitrile Chemical and Physical Properties
Names and Identifiers
-
- 2-{[5-(Trifluoromethyl)-2-pyridyl]oxy}acetonitrile
- 2-[[5-(TRIFLUOROMETHYL)-2-PYRIDYL]OXY]ACETONITRILE
- 2-[5-(trifluoromethyl)pyridin-2-yl]oxyacetonitrile
- 2-[[5-(TRIFLUOROMETHYL)-PYRIDIN-2-YL]OXY]ACETONITRILE
- HMS552D10
- 2-[5-(triluoromethyl)pyridin-2-yl]oxyacetonitrile
- {[5-(Trifluoromethyl)pyridin-2-yl]oxy}acetonitrile
- SR-01000633500-1
- CHEBI:195112
- 680593-95-7
- 2-(5-(trifluoromethyl)pyridin-2-yloxy)acetonitrile
- MFCD00115017
- Maybridge1_003772
- WBPSSPKKMLLIIU-UHFFFAOYSA-N
- FT-0691518
- 2-((5-(Trifluoromethyl)-2-pyridyl)oxy)acetonitrile
- DTXSID40384598
- J-507679
- CCG-43594
-
- Inchi： 1S/C8H5F3N2O/c9-8(10,11)6-1-2-7(13-5-6)14-4-3-12/h1-2,5H,4H2
- InChI Key： WBPSSPKKMLLIIU-UHFFFAOYSA-N
- SMILES： FC(C1=CN=C(C=C1)OCC#N)(F)F
Computed Properties
- Exact Mass: 202.03500
- Monoisotopic Mass: 202.03539727g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 233
- 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: 1.8
- Topological Polar Surface Area: 45.9?2
Experimental Properties
- Melting Point: 131 °C
- PSA: 45.91000
- LogP: 2.00278
2-{[5-(Trifluoromethyl)-2-pyridyl]oxy}acetonitrile Related Literature
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
-
Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
-
Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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