AG00AG55

Name: 1,3-dimethyl-2-[(2-oxopropyl)sulfanyl]-1H-imidazol-3-ium chloride
Brand: Angene Chemical
SKU: AG00AG55

135273-74-4 | 1,3-dimethyl-2-[(2-oxopropyl)sulfanyl]-1H-imidazol-3-ium chloride

AG00AG55

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CAS Number	135273-74-4
Catalog Number	AG00AG55(AGN-PC-0PKJJN)
Chemical Name	1,3-dimethyl-2-[(2-oxopropyl)sulfanyl]-1H-imidazol-3-ium chloride
IUPAC Name	1-(1,3-dimethylimidazol-1-ium-2-yl)sulfanylpropan-2-one;chloride
InChI	InChI=1S/C8H13N2OS.ClH/c1-7(11)6-12-8-9(2)4-5-10(8)3;/h4-5H,6H2,1-3H3;1H/q+1;/p-1
InChI Key	NFZZAUJDSJWLTQ-UHFFFAOYSA-M
MDL Number	MFCD00898949
Molecular Formula	C8H13ClN2OS
Molecular Weight	220.7196
SMILES	[Cl-].CC(CSC1=[N+](C)C=CN1C)=O
Synonyms	1,3-dimethyl-2-((2-oxopropyl)thio)imidazolium, 2MeOTI chloride, 2MeOTI Chloride, 135273-74-4, CHEBI:72702, 1,3-dimethyl-2-[(2-oxopropyl)sulfanyl]-1H-imidazol-3-ium chloride, 1,3-dimethyl-2-[(2-oxopropyl)thio]imidazolium chloride, 1,3-Dimethyl-2-((2-oxopropyl)thio)imidazolium, AC1L52H8, CHEMBL487575, SCHEMBL1826025, SCHEMBL9798357, AKOS026742527, R283, >=98% (HPLC), 1,3-dimethyl-2[(2-oxopropyl)thio]imidazolium chloride, 1-(1,3-dimethylimidazol-1-ium-2-yl)sulfanylpropan-2-one chloride, 1,3-dimethyl-2-( imidazolium, CID196876, R283,

Complexity	164
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	220.044g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	220.715g/mol
Monoisotopic Mass	220.044g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	51.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited