Cas no 660-31-1 (Benzene, 1,3-bis(trifluoromethoxy)-)
660-31-1 structure
Product Name:Benzene, 1,3-bis(trifluoromethoxy)-
CAS No:660-31-1
MF:C8H4F6O2
MW:246.106583595276
CID:4116045
PubChem ID:54037416
Update Time:2025-04-24
Benzene, 1,3-bis(trifluoromethoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1,3-bis(trifluoromethoxy)-
- 1,3-bis(trifluoromethoxy)benzene
- ZGAXJOXLABWRFN-UHFFFAOYSA-N
- 660-31-1
- SCHEMBL3147185
-
- Inchi： 1S/C8H4F6O2/c9-7(10,11)15-5-2-1-3-6(4-5)16-8(12,13)14/h1-4H
- InChI Key： ZGAXJOXLABWRFN-UHFFFAOYSA-N
- SMILES： FC(OC1C=CC=C(C=1)OC(F)(F)F)(F)F
Computed Properties
- Exact Mass: 246.01154834g/mol
- Monoisotopic Mass: 246.01154834g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 202
- 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: 4.6
- Topological Polar Surface Area: 18.5?2
Benzene, 1,3-bis(trifluoromethoxy)- Related Literature
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
660-31-1 (Benzene, 1,3-bis(trifluoromethoxy)-) Related Products
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