AG01BC6D

Name: methyl 3-bromo-5-methanesulfonylbenzoate
Brand: Angene Chemical
SKU: AG01BC6D

154117-77-8 | methyl 3-bromo-5-methanesulfonylbenzoate

AG01BC6D

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CAS Number	154117-77-8
Catalog Number	AG01BC6D(AGN-PC-03KD2J)
Chemical Name	methyl 3-bromo-5-methanesulfonylbenzoate
IUPAC Name	methyl 3-bromo-5-methylsulfonylbenzoate
InChI	InChI=1S/C9H9BrO4S/c1-14-9(11)6-3-7(10)5-8(4-6)15(2,12)13/h3-5H,1-2H3
InChI Key	DQAABAZUHVDUMR-UHFFFAOYSA-N
MDL Number	MFCD24107069
Molecular Formula	C9H9BrO4S
Molecular Weight	293.1344
SMILES	COC(C1=CC(S(C)(=O)=O)=CC(Br)=C1)=O
Synonyms	154117-77-8, methyl 3-bromo-5-(methylsulfonyl)benzoate, methyl 3-bromo-5-methanesulfonylbenzoate, Benzoic acid, 3-bromo-5-(methylsulfonyl)-, methyl ester, SCHEMBL1495552, CTK0B1050, DTXSID10622434, DQAABAZUHVDUMR-UHFFFAOYSA-N, AKOS020007833, ZINC116347020, Methyl 3-bromo-5-(methanesulfonyl)benzoate,

Complexity	333
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	291.94g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	293.131g/mol
Monoisotopic Mass	291.94g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	68.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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