AG00ADF3

Name: Methyl 2-(methylsulfanyl)-4-(trifluoromethyl)benzoate
Brand: Angene Chemical
SKU: AG00ADF3

192805-69-9 | Methyl 2-(methylsulfanyl)-4-(trifluoromethyl)benzoate

AG00ADF3

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CAS Number	192805-69-9
Catalog Number	AG00ADF3(AGN-PC-0ND9JU)
Chemical Name	Methyl 2-(methylsulfanyl)-4-(trifluoromethyl)benzoate
IUPAC Name	methyl 2-methylsulfanyl-4-(trifluoromethyl)benzoate
InChI	InChI=1S/C10H9F3O2S/c1-15-9(14)7-4-3-6(10(11,12)13)5-8(7)16-2/h3-5H,1-2H3
InChI Key	GCTSLTMJLUIOGD-UHFFFAOYSA-N
MDL Number	MFCD14635484
Molecular Formula	C10H9F3O2S
Molecular Weight	250.2375
SMILES	CSC1=C(C(=O)OC)C=CC(=C1)C(F)(F)F
Synonyms	192805-69-9, methyl 2-(methylsulfanyl)-4-(trifluoromethyl)benzoate, Methyl 2-(methylthio)-4-(trifluoromethyl)benzoate, Methyl 2-Methylthio4-trifluoromethylbenzoate, SCHEMBL5843160, 2-Methylthio-4-trifluoromethylbenzoic Acid Methyl Ester, GCTSLTMJLUIOGD-UHFFFAOYSA-N, ZINC71790837, AKOS027447532, MCULE-9464743434, NE15809, FT-0717836, methyl 2-methylthio-4-trifluoromethylbenzoate, Z1281078907, METHYL 4-(TRIFLUOROMETHYL)-2-(METHYLTHIO)BENZOATE, Benzoic acid, 2-(methylthio)-4-(trifluoromethyl)-, methyl ester, CID10944828, Methyl 2-methylsulfanyl-4-(trifluoromethyl)benzoate,

Complexity	255
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	250.028g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	250.235g/mol
Monoisotopic Mass	250.028g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	51.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

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