N-Tosylaziridine - CAS 3634-89-7

Catalog:	BB022943
Product Name:	N-Tosylaziridine
CAS:	3634-89-7
Synonyms:	1-(4-methylphenyl)sulfonylaziridine

Technical Data

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Computed Properties

IUPAC Name:	1-(4-methylphenyl)sulfonylaziridine
Description:	Reagent for beta-aminoethylation as well as for chemical fixation of carbon dioxide via ring expansion reaction under atmospheric pressure.
Molecular Weight:	197.25
Molecular Formula:	C9H11NO2S
Canonical SMILES:	CC1=CC=C(C=C1)S(=O)(=O)N2CC2
InChI:	InChI=1S/C9H11NO2S/c1-8-2-4-9(5-3-8)13(11,12)10-6-7-10/h2-5H,6-7H2,1H3
InChI Key:	VBNWSEVVMYMVLC-UHFFFAOYSA-N
Solubility:	Water : Insoluble
Appearance:	White crystals
MDL:	MFCD00188412
LogP:	2.01800

Publication Number	Title	Priority Date
WO-2021043926-A1	Manganese chelate isomers	20190903
EP-3739026-A1	Polyaziridine polymers as lubricating oil additives	20190516
JP-2020186387-A	Polyaziridine polymer as a lubricating oil additive	20190516
EP-3739026-B1	Polyaziridine polymers as lubricating oil additives	20190516
CN-109734904-A	A kind of three circle heterocyclic ring ring-opening polymerisation of organic concerted catalysis without metal catalyst system	20181228

PMID	Publication Date	Title	Journal
22092039	20111219	Mn2+ complexes with 12-membered pyridine based macrocycles bearing carboxylate or phosphonate pendant arm: crystallographic, thermodynamic, kinetic, redox, and 1H/17O relaxation studies	Inorganic chemistry
21291173	20110304	Ag(I)-catalyzed regioselective ring-opening of N-tosylaziridine and N-tosylazetidine with S-, O-, and N-nucleophiles and tethered dinucleophiles	The Journal of organic chemistry
19655764	20090904	Birch reductive alkylation of biaryls: scope and limitations	The Journal of organic chemistry
19533707	20090713	A stereodivergent strategy to both product enantiomers from the same enantiomer of a stereoinducing catalyst: agelastatin A	Chemistry (Weinheim an der Bergstrasse, Germany)
17300205	20070316	Studies on the reaction of aziridines with nitriles and carbonyls: synthesis of imidazolines and oxazolidines	The Journal of organic chemistry

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Related Functional Groups

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[618-40-6]
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[78056-67-4]
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[2006278-12-0]
2-[(5-Bromo-3-pyridyl)oxy]-2-phenylacetonitrile

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	269
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	197.05104977
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	197.05104977
Rotatable Bond Count:	2
Topological Polar Surface Area:	45.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.2