Cas no 120270-47-5 (phenanthren-9-yl trifluoromethanesulfonate)
120270-47-5 structure
Product Name:phenanthren-9-yl trifluoromethanesulfonate
CAS No:120270-47-5
MF:C15H9F3O3S
MW:326.290373563766
CID:2617007
PubChem ID:14174947
Update Time:2025-04-21
phenanthren-9-yl trifluoromethanesulfonate Chemical and Physical Properties
Names and Identifiers
-
- phenanthren-9-yl trifluoromethanesulfonate
- Methanesulfonic acid, trifluoro-, 9-phenanthrenyl ester
- SCHEMBL6937631
- DTXCID50507751
- XKWZLWKDYGSKCD-UHFFFAOYSA-N
- 120270-47-5
- DTXSID30556969
-
- Inchi： 1S/C15H9F3O3S/c16-15(17,18)22(19,20)21-14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)14/h1-9H
- InChI Key： XKWZLWKDYGSKCD-UHFFFAOYSA-N
- SMILES： S(C(F)(F)F)(=O)(=O)OC1C=C2C=CC=CC2=C2C=CC=CC2=1
Computed Properties
- Exact Mass: 326.02244980Da
- Monoisotopic Mass: 326.02244980Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 22
- Rotatable Bond Count: 2
- Complexity: 497
- 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: 5.2
- Topological Polar Surface Area: 51.8?2
phenanthren-9-yl trifluoromethanesulfonate Related Literature
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
-
Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
120270-47-5 (phenanthren-9-yl trifluoromethanesulfonate) Related Products
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