Cas no 30031-63-1 (1,2-Ethanediol,1-oxiranyl-, 2-methanesulfonate, [S-(R*,R*)]- (9CI))
30031-63-1 structure
Product Name:1,2-Ethanediol,1-oxiranyl-, 2-methanesulfonate, [S-(R*,R*)]- (9CI)
CAS No:30031-63-1
MF:C5H10O5S
MW:182.194900989532
CID:316400
PubChem ID:161653
Update Time:2025-04-19
1,2-Ethanediol,1-oxiranyl-, 2-methanesulfonate, [S-(R*,R*)]- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Ethanediol,1-oxiranyl-, 2-methanesulfonate, [S-(R*,R*)]- (9CI)
- [(2S)-2-hydroxy-2-[(2S)-oxiran-2-yl]ethyl] methanesulfonate
- DTXSID90184101
- (2s,3s)-1,2-epoxy-3,4-butanediol 4-methanesulfonate
- (2S,3S)-3,4-Epoxy-2-hydroxybutyl methanesulfonate
- (S-(R*,R*))-1-Oxiranyl-1,2-ethanediol 2-methanesulfonate
- 1,2-Ethanediol, 1-oxiranyl-, 2-methanesulfonate, (S-(R*,R*))-
- 30031-63-1
-
- Inchi: 1S/C5H10O5S/c1-11(7,8)10-2-4(6)5-3-9-5/h4-6H,2-3H2,1H3/t4-,5-/m0/s1
- InChI Key: RWHFAHDZGBOUSK-WHFBIAKZSA-N
- SMILES: S(C)(=O)(=O)OC[C@@H]([C@@H]1CO1)O
Computed Properties
- Exact Mass: 182.0249
- Monoisotopic Mass: 182.025
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 4
- Complexity: 216
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -1.3
- Topological Polar Surface Area: 84.5?2
Experimental Properties
- Density: 1.502
- Boiling Point: 391.6°Cat760mmHg
- Flash Point: 190.6°C
- Refractive Index: 1.521
- PSA: 76.13
1,2-Ethanediol,1-oxiranyl-, 2-methanesulfonate, [S-(R*,R*)]- (9CI) Related Literature
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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5. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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