AG00HBN4

Name: 4-[(Piperidin-1-ylsulfonyl)methyl]benzoic Acid
Brand: Angene Chemical
SKU: AG00HBN4

1099184-76-5 | 4-[(Piperidin-1-ylsulfonyl)methyl]benzoic Acid

AG00HBN4

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CAS Number	1099184-76-5
Catalog Number	AG00HBN4(AGN-PC-0WCW73)
Chemical Name	4-[(Piperidin-1-ylsulfonyl)methyl]benzoic Acid
IUPAC Name	4-(piperidin-1-ylsulfonylmethyl)benzoic acid
InChI	InChI=1S/C13H17NO4S/c15-13(16)12-6-4-11(5-7-12)10-19(17,18)14-8-2-1-3-9-14/h4-7H,1-3,8-10H2,(H,15,16)
InChI Key	LKYJIOGEHCYIPY-UHFFFAOYSA-N
MDL Number	MFCD12754214
Molecular Formula	C13H17NO4S
Molecular Weight	283.3434
SMILES	OC(=O)c1ccc(cc1)CS(=O)(=O)N1CCCCC1
Synonyms	4-[(Piperidin-1-ylsulfonyl)methyl]benzoic acid, 1099184-76-5, ALBB-029681, ZX-AN080494, MFCD12754214, ZINC37465687, AKOS009383764, IMED400359209, benzoic acid, 4-[(1-piperidinylsulfonyl)methyl]-,

Complexity	401
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	283.088g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	283.342g/mol
Monoisotopic Mass	283.088g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	83.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

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