AG00I381

Name: Methyl 4-methanesulfonyl-2-(trifluoromethyl)benzoate
Brand: Angene Chemical
SKU: AG00I381

1951440-91-7 | Methyl 4-methanesulfonyl-2-(trifluoromethyl)benzoate

AG00I381

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CAS Number	1951440-91-7
Catalog Number	AG00I381(AGN-PC-0WP1SW)
Chemical Name	Methyl 4-methanesulfonyl-2-(trifluoromethyl)benzoate
IUPAC Name	methyl 4-methylsulfonyl-2-(trifluoromethyl)benzoate
InChI	InChI=1S/C10H9F3O4S/c1-17-9(14)7-4-3-6(18(2,15)16)5-8(7)10(11,12)13/h3-5H,1-2H3
InChI Key	YTXQPCSIPPHEEF-UHFFFAOYSA-N
MDL Number	MFCD29917485
Molecular Formula	C10H9F3O4S
Molecular Weight	282.2363
SMILES	COC(=O)c1ccc(cc1C(F)(F)F)S(=O)(=O)C
Synonyms	Methyl 4-methanesulfonyl-2-(trifluoromethyl)benzoate, 1951440-91-7,

Complexity	410
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	282.017g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	282.233g/mol
Monoisotopic Mass	282.017g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	68.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

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