Cas no 15895-67-7 (Benzonitrile,2,3,5,6-tetrafluoro-4-(2,3,4,5,6-pentafluorophenoxy)-)
15895-67-7 structure
Product Name:Benzonitrile,2,3,5,6-tetrafluoro-4-(2,3,4,5,6-pentafluorophenoxy)-
CAS No:15895-67-7
MF:C13F9NO
MW:357.130834579468
CID:217330
PubChem ID:297559
Update Time:2025-04-19
Benzonitrile,2,3,5,6-tetrafluoro-4-(2,3,4,5,6-pentafluorophenoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzonitrile,2,3,5,6-tetrafluoro-4-(2,3,4,5,6-pentafluorophenoxy)-
- 2,3,5,6-tetrafluoro-4-(2,3,4,5,6-pentafluorophenoxy)benzonitrile
- 2,3,5,6-Tetrafluoro-4-(pentafluorophenoxy)benzonitrile
- NSC168742
- DTXSID40305001
- 15895-67-7
- NSC-168742
-
- Inchi： 1S/C13F9NO/c14-3-2(1-23)4(15)9(20)12(8(3)19)24-13-10(21)6(17)5(16)7(18)11(13)22
- InChI Key： ZLOKLQAVAHSIPC-UHFFFAOYSA-N
- SMILES： FC1C(=C(C(=C(C=1OC1C(=C(C(C#N)=C(C=1F)F)F)F)F)F)F)F
Computed Properties
- Exact Mass: 356.9836
- Monoisotopic Mass: 356.98361708g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 11
- Heavy Atom Count: 24
- Rotatable Bond Count: 2
- Complexity: 469
- 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: 4.1
- Topological Polar Surface Area: 33?2
Experimental Properties
- PSA: 33.02
Benzonitrile,2,3,5,6-tetrafluoro-4-(2,3,4,5,6-pentafluorophenoxy)- Related Literature
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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2. An integrated microfluidic 3D tumor system for parallel and high-throughput chemotherapy evaluation?Dan Liu,Rui Hu,Zhongchao Huang,Meilin Sun,Kai Han Analyst, 2020,145, 6447-6455
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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