Cas no 4726-22-1 (Phenol, 2-amino-4-[[2-(sulfooxy)ethyl]sulfonyl]-)
4726-22-1 structure
Product Name:Phenol, 2-amino-4-[[2-(sulfooxy)ethyl]sulfonyl]-
CAS No:4726-22-1
MF:C8H11NO7S2
MW:297.305440187454
CID:329507
PubChem ID:78455
Update Time:2025-04-19
Phenol, 2-amino-4-[[2-(sulfooxy)ethyl]sulfonyl]- Chemical and Physical Properties
Names and Identifiers
-
- Phenol, 2-amino-4-[[2-(sulfooxy)ethyl]sulfonyl]-
- 2-(3-amino-4-hydroxyphenyl)sulfonylethyl hydrogen sulfate
- 2-AMINO-4-{[2-(SULFOXY)-ETHYL]SULFONYL}-PHENOL
- AC1L2V9M
- AC1Q6XLI
- AG-F-60914
- AR-1L0288
- CTK1D6155
- Phenol, 2-amino-4-((2-(sulfooxy)ethyl)sulfonyl)-
- 2-(3-amino-4-hydroxyphenylsulfonyl)ethyl hydrogen sulfate
- 4726-22-1
- AC-13078
- DTXSID0063577
- AKOS015961242
- 2-AMINO-4-([2-(SULFOXY)-ETHYL]SULFONYL)-PHENOL
- SCHEMBL5673668
-
- Inchi: 1S/C8H11NO7S2/c9-7-5-6(1-2-8(7)10)17(11,12)4-3-16-18(13,14)15/h1-2,5,10H,3-4,9H2,(H,13,14,15)
- InChI Key: SLLSIPBBZZFAKY-UHFFFAOYSA-N
- SMILES: S(C1C=CC(=C(C=1)N)O)(CCOS(=O)(=O)O)(=O)=O
Computed Properties
- Exact Mass: 296.99800
- Monoisotopic Mass: 296.99769404g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 461
- 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: -0.9
- Topological Polar Surface Area: 161?2
Experimental Properties
- PSA: 160.75000
- LogP: 2.31030
Phenol, 2-amino-4-[[2-(sulfooxy)ethyl]sulfonyl]- Related Literature
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Mei Zhang,Jingjing Guo,Tingting Liu,Zhanyu He,Majeed Irfan,Zujin Zhao,Zhuo Zeng J. Mater. Chem. C, 2020,8, 14919-14924
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