Cas no 88318-15-4 (Benzenethiol, 4-(2-ethoxyethoxy)-)
88318-15-4 structure
Product Name:Benzenethiol, 4-(2-ethoxyethoxy)-
CAS No:88318-15-4
MF:C10H14O2S
MW:198.281961917877
CID:637512
PubChem ID:14794022
Update Time:2025-04-19
Benzenethiol, 4-(2-ethoxyethoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenethiol, 4-(2-ethoxyethoxy)-
- 4-(2-ethoxyethoxy)benzenethiol
- DTXSID80564110
- SCHEMBL12411389
- 4-(2-Ethoxyethoxy)benzene-1-thiol
- 88318-15-4
-
- Inchi: 1S/C10H14O2S/c1-2-11-7-8-12-9-3-5-10(13)6-4-9/h3-6,13H,2,7-8H2,1H3
- InChI Key: SRRKWUOXHQCTAA-UHFFFAOYSA-N
- SMILES: SC1C=CC(=CC=1)OCCOCC
Computed Properties
- Exact Mass: 198.07145086g/mol
- Monoisotopic Mass: 198.07145086g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 5
- Complexity: 122
- 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: 2.3
- Topological Polar Surface Area: 19.5?2
Benzenethiol, 4-(2-ethoxyethoxy)- Related Literature
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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