AG006KCV

Name: Methyl 5-bromo-2-(methylthio)benzoate
Brand: Angene Chemical
SKU: AG006KCV

929000-14-6 | Methyl 5-bromo-2-(methylthio)benzoate

AG006KCV

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CAS Number	929000-14-6
Catalog Number	AG006KCV(AGN-PC-0WADZM)
Chemical Name	Methyl 5-bromo-2-(methylthio)benzoate
IUPAC Name	methyl 5-bromo-2-methylsulfanylbenzoate
InChI	InChI=1S/C9H9BrO2S/c1-12-9(11)7-5-6(10)3-4-8(7)13-2/h3-5H,1-2H3
InChI Key	AUJZLQVDLUTYLJ-UHFFFAOYSA-N
MDL Number	MFCD09258758
Molecular Formula	C9H9BrO2S
Molecular Weight	261.1356
SMILES	O=C(OC)C1=CC(Br)=CC=C1SC
Synonyms	Methyl 5-bromo-2-(methylthio)benzoate, 929000-14-6, methyl 5-bromo-2-(methylsulfanyl)benzoate, ACMC-209rik, SCHEMBL424811, CTK5H1850, DTXSID40650321, AUJZLQVDLUTYLJ-UHFFFAOYSA-N, Methyl 5-bromo-2-methylthiobenzoate, ANW-39930, MFCD09258758, ZINC16123711, AKOS015834748, RTR-029110, methyl 5-bromo-2-methylsulfanylbenzoate, AJ-68250, AS-43727, DA-00840, TR-029110, FT-0730329, V9218, B-5488, I01-10976, C9H9BrO2S,

Complexity	187
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	259.951g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	261.133g/mol
Monoisotopic Mass	259.951g/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