Cas no 870448-66-1 (2-(Thiophen-2-yl)ethyl naphthalene-2-sulfonate)
870448-66-1 structure
Product Name:2-(Thiophen-2-yl)ethyl naphthalene-2-sulfonate
CAS No:870448-66-1
MF:C16H14O3S2
MW:318.410562038422
CID:2809733
PubChem ID:71405942
Update Time:2025-04-21
2-(Thiophen-2-yl)ethyl naphthalene-2-sulfonate Chemical and Physical Properties
Names and Identifiers
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- DTXSID00826565
- 2-(Thiophen-2-yl)ethyl naphthalene-2-sulfonate
- 870448-66-1
-
- Inchi： 1S/C16H14O3S2/c17-21(18,19-10-9-15-6-3-11-20-15)16-8-7-13-4-1-2-5-14(13)12-16/h1-8,11-12H,9-10H2
- InChI Key： MGQWQGDCRROEGN-UHFFFAOYSA-N
- SMILES： S(C1C=CC2C=CC=CC=2C=1)(=O)(=O)OCCC1=CC=CS1
Computed Properties
- Exact Mass: 318.03843665Da
- Monoisotopic Mass: 318.03843665Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 5
- Complexity: 429
- 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: 80?2
2-(Thiophen-2-yl)ethyl naphthalene-2-sulfonate Related Literature
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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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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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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