AG00BIF1

Name: 4-(Methanesulfonylmethyl)benzoic acid
Brand: Angene Chemical
SKU: AG00BIF1

199535-00-7 | 4-(Methanesulfonylmethyl)benzoic acid

AG00BIF1

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CAS Number	199535-00-7
Catalog Number	AG00BIF1(AGN-PC-0JS22G)
Chemical Name	4-(Methanesulfonylmethyl)benzoic acid
IUPAC Name	4-(methylsulfonylmethyl)benzoic acid
InChI	InChI=1S/C9H10O4S/c1-14(12,13)6-7-2-4-8(5-3-7)9(10)11/h2-5H,6H2,1H3,(H,10,11)
InChI Key	HPGPGXQMPNJNPV-UHFFFAOYSA-N
MDL Number	MFCD06384990
Molecular Formula	C9H10O4S
Molecular Weight	214.2383
SMILES	CS(=O)(=O)CC1=CC=C(C(=O)O)C=C1
Synonyms	4-(Methanesulfonylmethyl)benzoic acid, 199535-00-7, 4-[(methylsulfonyl)methyl]benzoic acid, 4-(methylsulfonylmethyl)benzoic acid, AC1LA2JU, AC1Q4GM2, SCHEMBL402122, CHEMBL131956, CTK7I7939, HPGPGXQMPNJNPV-UHFFFAOYSA-N, 4-methanesulfonylmethylbenzoic acid, HMS1729L08, ZINC3491371, 4-Methanesulfonylmethyl-benzoic acid, MFCD06384990, AKOS000122862, MCULE-6365464356, BS-13907, Benzoic acid, 4-[(methylsulfonyl)methyl]-, FT-0718581, V4141, EN300-12152, K-5835, SR-01000064320, SR-01000064320-1, C9H10O4S, AIDS169347, CID506069,

Complexity	293
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	214.03g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	214.235g/mol
Monoisotopic Mass	214.03g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	79.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

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