Cas no 15592-57-1 (2-Oxiranemethanol,2-benzenesulfonate)
15592-57-1 structure
Product Name:2-Oxiranemethanol,2-benzenesulfonate
CAS No:15592-57-1
MF:C9H10O4S
MW:214.238301753998
CID:203670
PubChem ID:286828
Update Time:2025-04-19
2-Oxiranemethanol,2-benzenesulfonate Chemical and Physical Properties
Names and Identifiers
-
- 2-Oxiranemethanol,2-benzenesulfonate
- oxiran-2-ylmethyl benzenesulfonate
- 2-Benzolsulfonyloxymethyl-aethylenoxid
- AC1L6629
- AC1Q6Y75
- AG-K-90417
- AGN-PC-0D9LMX
- AR-1K9382
- benzenesulfonyloxymethyl-oxirane
- CTK4C8884
- glycidyl benzenesulfonate
- glycidyl benzenesulphonate
- NSC145996
- NSC-145996
- DTXSID20301708
- 2-Oxiranemethanol, 2-benzenesulfonate
- SCHEMBL58865
- AKOS021983022
- 15592-57-1
-
- Inchi: 1S/C9H10O4S/c10-14(11,13-7-8-6-12-8)9-4-2-1-3-5-9/h1-5,8H,6-7H2
- InChI Key: PGIGXJYEXSOUNZ-UHFFFAOYSA-N
- SMILES: S(C1C=CC=CC=1)(=O)(=O)OCC1CO1
Computed Properties
- Exact Mass: 214.03
- Monoisotopic Mass: 214.02997997g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 274
- 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: 0.9
- Topological Polar Surface Area: 64.3?2
Experimental Properties
- PSA: 55.9
2-Oxiranemethanol,2-benzenesulfonate Related Literature
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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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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