Cas no 50855-43-1 (Benzenesulfonic acid,hydroxymethoxy-)
50855-43-1 structure
Product Name:Benzenesulfonic acid,hydroxymethoxy-
CAS No:50855-43-1
MF:C7H8O5S
MW:204.200421333313
CID:369617
PubChem ID:159379
Update Time:2025-04-19
Benzenesulfonic acid,hydroxymethoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonic acid,hydroxymethoxy-
- hydroxymethoxybenzenesulphonic acid
- Guaiacolsulfonate
- Guaiacolsulfonic acid
- Thiocol
- hydroxymethoxybenzene sulfonic acid
- 728856-24-4
- hydroxymethoxybenzenesulphonicacid
- SCHEMBL10886678
- 2-(hydroxymethoxy)benzenesulfonic acid
- NS00001884
- 2-(Hydroxymethoxy)benzene-1-sulfonic acid
- DTXSID20862622
- 50855-43-1
- 2-(hydroxymethoxy)benzenesulfonicacid
-
- Inchi： 1S/C7H8O5S/c8-5-12-6-3-1-2-4-7(6)13(9,10)11/h1-4,8H,5H2,(H,9,10,11)
- InChI Key： GUAPLPVVNZYPSJ-UHFFFAOYSA-N
- SMILES： S(C1C=CC=CC=1OCO)(=O)(=O)O
Computed Properties
- Exact Mass: 204.00924
- Monoisotopic Mass: 204.009
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 242
- 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
- Topological Polar Surface Area: 92.2A^2
- XLogP3: 0.1
Experimental Properties
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- PSA: 83.83
Benzenesulfonic acid,hydroxymethoxy- Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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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
-
Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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