AG00APR6

Name: 4-(Pyrrolidin-1-Ylsulfonyl)Benzoic Acid
Brand: Angene Chemical
SKU: AG00APR6

19580-33-7 | 4-(Pyrrolidin-1-Ylsulfonyl)Benzoic Acid

AG00APR6

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CAS Number	19580-33-7
Catalog Number	AG00APR6(AGN-PC-0JW2MK)
Chemical Name	4-(Pyrrolidin-1-Ylsulfonyl)Benzoic Acid
IUPAC Name	4-pyrrolidin-1-ylsulfonylbenzoic acid
InChI	InChI=1S/C11H13NO4S/c13-11(14)9-3-5-10(6-4-9)17(15,16)12-7-1-2-8-12/h3-6H,1-2,7-8H2,(H,13,14)
InChI Key	LTIXOYIZMIXNIK-UHFFFAOYSA-N
MDL Number	MFCD00551820
Molecular Formula	C11H13NO4S
Molecular Weight	255.2902
SMILES	OC(=O)c1ccc(cc1)S(=O)(=O)N1CCCC1
Synonyms	4-(pyrrolidin-1-ylsulfonyl)benzoic acid, 4-(Pyrrolidine-1-sulfonyl)-benzoic acid, 19580-33-7, 4-pyrrolidin-1-ylsulfonylbenzoic acid, 4-(1-pyrrolidinylsulfonyl)benzoic acid, 4-(pyrrolidine-1-sulfonyl)benzoic acid, Benzoic acid, 4-(1-pyrrolidinylsulfonyl)-, 4-(pyrrolidinylsulfonyl)benzoic acid, BAS 02992729, AC1LG1IL, Cambridge id 5156993, Oprea1_002049, Oprea1_194744, CBDivE_003620, MLS001212215, IFLab1_001316, SCHEMBL3350798, CHEMBL1456250, CTK7I8122, DTXSID70354103, LTIXOYIZMIXNIK-UHFFFAOYSA-N, HMS1415L18, HMS2849J19, ZINC237810, AC1Q7375, ALBB-012768, 6602AD, BBL008254, MFCD00551820, SBB018301, STK803096, AKOS000112060, MCULE-8856543901, IDI1_009183, SMR000518010, AB0167121, TR-043621, BB 0237917, EU-0072578, ST45027938, EN300-00309, L-4166, AB00074677-01, AE-848/34430029, SR-01000443090, SR-01000443090-1, Z53035591, F0365-0027, C11H13NO4S, CID763651,

Complexity	373
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	255.057g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	255.288g/mol
Monoisotopic Mass	255.057g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	83.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

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