Cas no 89231-73-2 (Benzenesulfonamide, N-ethyl-N-(1-methylheptyl)-)
89231-73-2 structure
Product Name:Benzenesulfonamide, N-ethyl-N-(1-methylheptyl)-
CAS No:89231-73-2
MF:C16H27NO2S
MW:297.456083536148
CID:607532
PubChem ID:71322936
Update Time:2025-04-19
Benzenesulfonamide, N-ethyl-N-(1-methylheptyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonamide, N-ethyl-N-(1-methylheptyl)-
- N-ethyl-N-octan-2-ylbenzenesulfonamide
- N-ETHYL-N-(OCTAN-2-YL)BENZENESULFONAMIDE
- 89231-73-2
- DTXSID90752561
-
- Inchi： 1S/C16H27NO2S/c1-4-6-7-9-12-15(3)17(5-2)20(18,19)16-13-10-8-11-14-16/h8,10-11,13-15H,4-7,9,12H2,1-3H3
- InChI Key： HZHVMNXMMJCSRB-UHFFFAOYSA-N
- SMILES： S(C1C=CC=CC=1)(N(CC)C(C)CCCCCC)(=O)=O
Computed Properties
- Exact Mass: 297.17625028g/mol
- Monoisotopic Mass: 297.17625028g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 9
- Complexity: 342
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.7
- Topological Polar Surface Area: 45.8?2
Benzenesulfonamide, N-ethyl-N-(1-methylheptyl)- Related Literature
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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