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Safety Information

158844

Sigma-Aldrich

2-Methylthio-2-imidazoline hydriodide

99%

Synonym(s):

2-Methylsulfanyl-4,5-dihydro-1H-imidazole hydrogen iodide

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About This Item

Empirical Formula (Hill Notation):
C4H8N2S · HI
CAS Number:
Molecular Weight:
244.10
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

99%

form

powder

mp

144-146 °C (lit.)

SMILES string

I[H].CSC1=NCCN1

InChI

1S/C4H8N2S.HI/c1-7-4-5-2-3-6-4;/h2-3H2,1H3,(H,5,6);1H

InChI key

PZZRSEUDGCFXIH-UHFFFAOYSA-N

Application

2-Methylthio-2-imidazoline hydriodide was used in the preparation of starting materials required for the synthesis of 2-amino1-(2-Imidazolin-2-yl)-2-imidazoline.
Reactant for synthesis of:
Aurora and epidermal growth factor receptor kinase inhibitors
Spiro-piperidine inhibitors against influenza A virus
Galegine analogues for aided weight loss in mice
Guanidinyl pyrrolidines as bifunctional catalysts for enantioselective conjugate additions to cyclic enones
Carbonic anhydrase inhibitors
Small molecule CXCR4 antagonists

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

ISHL Indicated Name

Substances Subject to be Indicated Names

ISHL Notified Names

Substances Subject to be Notified Names

JAN Code

158844-25G:4.548173985985E12


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1-(2-Imidazolin-2-yl)-2-imidazolines. I. Structure of Jaffe's base and the chemistry of related compounds.
Wittekind RR, et al.
The Journal of Organic Chemistry, 38(9), 1641-1645 (1973)

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