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2,2,6,6-Tetramethyl-4-(4'-toluenesulfonate)piperidinooxyl

HCID 587713
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Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
42495-21-6
Standard SMILES
Cc1ccc(S(=O)(=O)OC2CC(C)(C)N(O)C(C)(C)C2)cc1
InChIKey
SRNPCPMNECAZKZ-UHFFFAOYSA-N
Molecular formula
C16H25NO4S
Average molar mass
327.4 g/mol
Monoisotopic mass
327.15042945

Names & identifiers

Preferred name
2,2,6,6-Tetramethyl-4-(4'-toluenesulfonate)piperidinooxyl
IUPAC
(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 4-methylbenzenesulfonate
English name
2,2,6,6-Tetramethyl-4-(4'-toluenesulfonate)piperidinooxyl
Molecular formula
C16H25NO4S
Molecular weight
327.439

Names & synonyms

42495-21-62,2,6,6-Tetramethyl-4-(4'-toluenesulfonate)piperidinooxylDTXSID00343141RefChem:242963DTXCID60294221(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) 4-methylbenzenesulfonate1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl 4-methylbenzenesulfonateSRNPCPMNECAZKZ-UHFFFAOYSA-NSCHEMBL19712291STK678310AKOS005594930ST032588
Show more names
4-Hydroxy-2,2,6,6-tetraMethyl-piperidinooxy p-Toluenesulfonate2,2,6,6-TetraMethyl-4-[[(4-Methylphenyl)sulfonyl]oxy]-1-piperidinyloxy
DB-2161261-hydroxy-2,2,6,6-tetramethyl-4-piperidyl 4-methylbenzenesulfonate1-Hydroxy-2,2,6,6-tetramethyl-4-piperidinyl 4-methylbenzenesulfonate #Toluene-4-sulfonic acid 1-hydroxy-2,2,6,6-tetramethyl-piperidin-4-yl ester1-HYDROXY-2,2,6,6-TETRAMETHYLPIPERIDIN-4-YL 4-METHYLBENZENE-1-SULFONATE1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl 4-methylbenzene-1-sulfonate--hydrogen chloride (1/1)2,2,6,6-Tetramethyl-4-[[(4-methylphenyl)sulfonyl]oxy]-1-piperidinyloxy; 4-Hydroxy-2,2,6,6-tetramethyl-piperidinooxy p-Toluenesulfonate;

Database identifiers

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
75.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
22
Formal charge
0
Complexity
469

Physicochemical properties

storage temp.
Refrigerator
solubility
soluble in No data available

Chemistry & industry

Applications

UsesAn intermediate in the preparation of Piperidine-1-oxyl derivatives.

Suppliers5 total

安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
艾吉析科技(上海)有限公司17717235263 17717235263 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
CAS
42495-21-6
PubChem CID
587713
DTXSID
DTXSID00343141