AG01AFG8

Name: Methyl 4-(S-methylsulfonimidoyl)benzoate
Brand: Angene Chemical
SKU: AG01AFG8

1147096-51-2 | Methyl 4-(S-methylsulfonimidoyl)benzoate

AG01AFG8

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CAS Number	1147096-51-2
Catalog Number	AG01AFG8
Chemical Name	Methyl 4-(S-methylsulfonimidoyl)benzoate
IUPAC Name	methyl 4-(methylsulfonimidoyl)benzoate
InChI	InChI=1S/C9H11NO3S/c1-13-9(11)7-3-5-8(6-4-7)14(2,10)12/h3-6,10H,1-2H3
InChI Key	HLJCURWEBARIDO-UHFFFAOYSA-N
MDL Number	MFCD25955873
Molecular Formula	C9H11NO3S
Molecular Weight	213.2535
SMILES	N=S(C1=CC=C(C(=O)OC)C=C1)(=O)C
Synonyms	1147096-51-2, methyl 4-[imino(methyl)oxo-lambda6-sulfanyl]benzoate, methyl 4-(S-methylsulfonimidoyl)benzoate, FCH2411936, J3.626.521C, EN300-153608, 4-(S-Methylsulfonimidoyl)benzoic acid methyl ester,

Complexity	312
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	213.046g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	213.251g/mol
Monoisotopic Mass	213.046g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	75.6A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	2.6

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