Cas no 871113-94-9 ([1,1'-Biphenyl]-3-sulfonamide, N-(4-hydroxybutyl)-4'-(trifluoromethyl)-)
![[1,1'-Biphenyl]-3-sulfonamide, N-(4-hydroxybutyl)-4'-(trifluoromethyl)- structure](https://ossimg.kuujia.com/scimg/871500/871113-94-9x500.png)
871113-94-9 structure
Product Name:[1,1'-Biphenyl]-3-sulfonamide, N-(4-hydroxybutyl)-4'-(trifluoromethyl)-
CAS No:871113-94-9
MF:C17H18F3NO3S
MW:373.389934062958
CID:659258
PubChem ID:11523628
Update Time:2025-04-19
[1,1'-Biphenyl]-3-sulfonamide, N-(4-hydroxybutyl)-4'-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
-
- [1,1'-Biphenyl]-3-sulfonamide, N-(4-hydroxybutyl)-4'-(trifluoromethyl)-
- N-(4-hydroxybutyl)-3-[4-(trifluoromethyl)phenyl]benzenesulfonamide
- 4'-Trifluoromethylbiphenyl-3-sulfonic acid (4-hydroxy-butyl)-amide
- 871113-94-9
- SCHEMBL2009231
- CHEMBL216221
- DTXSID50468035
-
- Inchi： 1S/C17H18F3NO3S/c18-17(19,20)15-8-6-13(7-9-15)14-4-3-5-16(12-14)25(23,24)21-10-1-2-11-22/h3-9,12,21-22H,1-2,10-11H2
- InChI Key： MXKJKTPKNUATNJ-UHFFFAOYSA-N
- SMILES： S(C1C=CC=C(C2C=CC(C(F)(F)F)=CC=2)C=1)(NCCCCO)(=O)=O
Computed Properties
- Exact Mass: 373.09594910g/mol
- Monoisotopic Mass: 373.09594910g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 25
- Rotatable Bond Count: 7
- Complexity: 496
- 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: 3.4
- Topological Polar Surface Area: 74.8?2
[1,1'-Biphenyl]-3-sulfonamide, N-(4-hydroxybutyl)-4'-(trifluoromethyl)- Related Literature
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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