AG01A3F2

Name: 4-Bromo-3-(chlorosulfonyl)-5-methylbenzoic acid
Brand: Angene Chemical
SKU: AG01A3F2

849333-58-0 | 4-Bromo-3-(chlorosulfonyl)-5-methylbenzoic acid

AG01A3F2

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CAS Number	849333-58-0
Catalog Number	AG01A3F2(AGN-PC-07CEX4)
Chemical Name	4-Bromo-3-(chlorosulfonyl)-5-methylbenzoic acid
IUPAC Name	4-bromo-3-chlorosulfonyl-5-methylbenzoic acid
InChI	InChI=1S/C8H6BrClO4S/c1-4-2-5(8(11)12)3-6(7(4)9)15(10,13)14/h2-3H,1H3,(H,11,12)
InChI Key	WKVPXUFUECCEED-UHFFFAOYSA-N
MDL Number	MFCD09029773
Molecular Formula	C8H6BrClO4S
Molecular Weight	313.5528
SMILES	CC1=C(Br)C(S(Cl)(=O)=O)=CC(C(O)=O)=C1
Synonyms	4-bromo-3-(chlorosulfonyl)-5-methylbenzoic acid, 849333-58-0, 4-BROMO-3-CHLOROSULFONYL-5-METHYL-BENZOIC ACID, SCHEMBL2009627, CTK7I6676, WKVPXUFUECCEED-UHFFFAOYSA-N, AKOS015962656, ZINC100033465, NE14065, 4-Bromo-3-methyl-5-(chlorosulfonyl)benzoic acid,

Complexity	350
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	311.886g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	313.546g/mol
Monoisotopic Mass	311.886g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	79.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

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