AG003HMA

Name: 2-Methyl-3-(methylsulfonyl)benzoic Acid
Brand: Angene Chemical
SKU: AG003HMA

1186663-49-9 | 2-Methyl-3-(methylsulfonyl)benzoic Acid

AG003HMA

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CAS Number	1186663-49-9
Catalog Number	AG003HMA(AGN-PC-09T3X5)
Chemical Name	2-Methyl-3-(methylsulfonyl)benzoic Acid
IUPAC Name	2-methyl-3-methylsulfonylbenzoic acid
InChI	InChI=1S/C9H10O4S/c1-6-7(9(10)11)4-3-5-8(6)14(2,12)13/h3-5H,1-2H3,(H,10,11)
InChI Key	WMALKKDIJHZYRM-UHFFFAOYSA-N
MDL Number	MFCD12828710
Molecular Formula	C9H10O4S
Molecular Weight	214.2383
SMILES	CC1=C(C=CC=C1C(O)=O)S(C)(=O)=O
Synonyms	2-METHYL-3-(METHYLSULFONYL)BENZOIC ACID, 1186663-49-9, 2-methyl-3-methylsulfonylbenzoic acid, 2-Methyl-3-(methylsulfonyl)benzoicAcid, SCHEMBL147992, CTK7I8808, KS-00000CIB, WMALKKDIJHZYRM-UHFFFAOYSA-N, 3-Methanesulfonylmethylbenzoic acid, 5582AJ, ZINC42684407, 3-methanesulfonyl-2-methylbenzoic acid, AKOS015852474, TRA0094561, AS-31979, SY006348, AB0065562, DB-014547, TR-056635, FT-0769788, Z-3985, MFCD12828710 (97+%), 3-Methanesulfonylmethyl-benzoic acid, C9H10O4S, AJ-104569, 261924-94-1,

Complexity	314
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	214.02998g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	214.24g/mol
Monoisotopic Mass	214.02998g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	79.8Å²
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

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