AG00VSG9

Name: 3-(3,4-dimethoxybenzenesulfonyl)propanoic acid
Brand: Angene Chemical
SKU: AG00VSG9

100059-84-5 | 3-(3,4-dimethoxybenzenesulfonyl)propanoic acid

AG00VSG9

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CAS Number	100059-84-5
Catalog Number	AG00VSG9(AGN-PC-0WBKCI)
Chemical Name	3-(3,4-dimethoxybenzenesulfonyl)propanoic acid
IUPAC Name	3-(3,4-dimethoxyphenyl)sulfonylpropanoic acid
InChI	InChI=1S/C11H14O6S/c1-16-9-4-3-8(7-10(9)17-2)18(14,15)6-5-11(12)13/h3-4,7H,5-6H2,1-2H3,(H,12,13)
InChI Key	KRBIPGZIRGLRBB-UHFFFAOYSA-N
MDL Number	MFCD09893520
Molecular Formula	C11H14O6S
Molecular Weight	274.2903
SMILES	COC1=C(OC)C=C(S(CCC(O)=O)(=O)=O)C=C1
Synonyms	3-(3,4-dimethoxybenzenesulfonyl)propanoic acid, 100059-84-5, 3-((3,4-dimethoxyphenyl)sulfonyl)propanoic acid, 3-[(3,4-dimethoxyphenyl)sulfonyl]propanoic acid, BBL012320, MFCD09893520, STK803172, ZINC11895942, AKOS002676371, MCULE-5012425567, NE18272, BB 0219374, EN300-83069, 3-[(3,4-dimethoxybenzene)sulfonyl]propanoic acid, Z1255523402, 3-(3,4-dimethoxyphenyl)sulfonylpropanoic acid,

Complexity	372
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	274.051g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	274.287g/mol
Monoisotopic Mass	274.051g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	98.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

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