AG00C1AC

22132-99-6 | S-Methyl-S-(4-chlorophenyl) sulfoximine

AG00C1AC

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CAS Number	22132-99-6
Catalog Number	AG00C1AC(AGN-PC-0NJ228)
Chemical Name	S-Methyl-S-(4-chlorophenyl) sulfoximine
IUPAC Name	(4-chlorophenyl)-imino-methyl-oxo-λ6-sulfane
InChI	InChI=1S/C7H8ClNOS/c1-11(9,10)7-4-2-6(8)3-5-7/h2-5,9H,1H3
InChI Key	XSKJSJPUIQNRSQ-UHFFFAOYSA-N
MDL Number	MFCD00173771
Molecular Formula	C7H8ClNOS
Molecular Weight	189.6625
SMILES	CS(=O)(=N)C1=CC=C(C=C1)Cl
Synonyms	22132-99-6, S-METHYL-S-(4-CHLOROPHENYL) SULFOXIMINE, SCHEMBL486726, CHEMBL4097241, AKOS006273334, Sulfoximine, S-(4-chlorophenyl)-S-methyl-, 1-Chloro-4-(S-methylsulfonimidoyl)benzene, S-Methyl-S-(4-chlorophenyl) sulfoximine, 95% - 1G 1g, S-Methyl-S-(4-chlorophenyl) sulfoximine, 95% - 500MG 500mg,

Complexity	227
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	189.002g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	189.657g/mol
Monoisotopic Mass	189.002g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	49.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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