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N-Hydroxy-2,4,6-trimethylbenzenesulfonamide

N-Hydroxy-2,4,6-trimethylbenzenesulfonamide - CAS 58042-39-0

Catalog:	BB029912
Product Name:	N-Hydroxy-2,4,6-trimethylbenzenesulfonamide
CAS:	58042-39-0
Synonyms:	N-hydroxy-2,4,6-trimethylbenzenesulfonamide; N-hydroxy-2,4,6-trimethylbenzenesulfonamide

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Computed Properties

IUPAC Name:	N-hydroxy-2,4,6-trimethylbenzenesulfonamide
Description:	N-Hydroxy-2,4,6-trimethylbenzenesulfonamide (CAS# 58042-39-0) is a useful research chemical.
Molecular Weight:	215.27
Molecular Formula:	C9H13NO3S
Canonical SMILES:	CC1=CC(=C(C(=C1)C)S(=O)(=O)NO)C
InChI:	InChI=1S/C9H13NO3S/c1-6-4-7(2)9(8(3)5-6)14(12,13)10-11/h4-5,10-11H,1-3H3
InChI Key:	RRPKGUUYTHFUPN-UHFFFAOYSA-N
Appearance:	White to yellow solid
LogP:	2.75100

Publication Number	Title	Priority Date
CN-112552339-A	Preparation method of O-diphenylphosphoryl hydroxylamine	20201210
CN-112851664-A	Pyrazolo [1,5-a ] pyridine-3-nitrile compound and application thereof in medicine	20191112
WO-2021053110-A1	Pesticidally active heterocyclic derivatives with sulfur and sulfoximine containing substituents	20190920
CN-112300173-A	Nitrogen-containing polycyclic compounds, preparation method and application	20190730
CN-112300173-B	Nitrogen-containing polycyclic compounds, preparation method and application	20190730

PMID	Publication Date	Title	Journal
18357986	20080416	Facile conversion of cysteine and alkyl cysteines to dehydroalanine on protein surfaces: versatile and switchable access to functionalized proteins	Journal of the American Chemical Society
17165938	20061221	Mild preparation of alkenes from phenyl sulfides: one-pot elimination of phenylthio group via sulfilimine at ambient temperature	Organic letters
15760228	20050318	Synthesis and palladium-catalyzed coupling reactions of enantiopure p-bromophenyl methyl sulfoximine	The Journal of organic chemistry
15067182	20040401	[How have we found any new reactions in the field of the heterocyclic chemistry?]	Yakugaku zasshi : Journal of the Pharmaceutical Society of Japan
12946163	20030905	Highly efficient synthesis of O-(2,4-dinitrophenyl)hydroxylamine. Application to the synthesis of substituted N-benzoyliminopyridinium ylides	The Journal of organic chemistry

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Complexity:	271
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	215.06161445
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	215.06161445
Rotatable Bond Count:	2
Topological Polar Surface Area:	74.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5