AG00BH0N

Name: 3-(Morpholinosulfonyl)benzoic acid
Brand: Angene Chemical
SKU: AG00BH0N

299181-75-2 | 3-(Morpholinosulfonyl)benzoic acid

AG00BH0N

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CAS Number	299181-75-2
Catalog Number	AG00BH0N(AGN-PC-0JNU5C)
Chemical Name	3-(Morpholinosulfonyl)benzoic acid
IUPAC Name	3-morpholin-4-ylsulfonylbenzoic acid
InChI	InChI=1S/C11H13NO5S/c13-11(14)9-2-1-3-10(8-9)18(15,16)12-4-6-17-7-5-12/h1-3,8H,4-7H2,(H,13,14)
InChI Key	LYGWBPDKDLWHHB-UHFFFAOYSA-N
MDL Number	MFCD00622729
Molecular Formula	C11H13NO5S
Molecular Weight	271.2896
NSC Number	85519
SMILES	O=C(O)C1=CC=CC(S(=O)(N2CCOCC2)=O)=C1
Synonyms	299181-75-2, 3-(Morpholinosulfonyl)benzoic acid, 3-(Morpholine-4-sulfonyl)benzoic acid, 3-(morpholinosulfonyl)benzenecarboxylic acid, 3-(Morpholine-4-sulfonyl)-benzoic acid, 3-(morpholin-4-ylsulfonyl)benzoic acid, 3-morpholin-4-ylsulfonylbenzoic acid, Benzoic acid, 3-(4-morpholinylsulfonyl)-, NSC85519, ACMC-209hbz, AC1L5WUW, NCIOpen2_005063, Oprea1_553719, Oprea1_854691, SCHEMBL34841, MLS000058857, AC1Q73J4, CHEMBL1602680, CTK7I8765, DTXSID80292784, LYGWBPDKDLWHHB-UHFFFAOYSA-N, HMS2465H23, ZINC227008, ALBB-029703, ANW-26733, BBL013166, MFCD00622729, morpholinosulfonylbenzenecarboxylicacid, NSC-85519, STK696320, 3-(4-morpholinylsulfonyl)benzoic acid, AKOS000114633, MCULE-6671461623, NE11626, RP15159, KS-0000211E, AJ-18096, BAS 00086775, SMR000069426, 3-[(Morpholin-4-yl)sulfonyl]benzoic acid, RT-019496, TR-063987, BB 0221965, FT-0680697, ST24028345, ST50490437, V4999, EN300-00278, AB00080749-01, 8Y-0008, SR-01000399034, J-510910, SR-01000399034-1, I01-16039, Z53036601, A1071/0050247, 2-methyl-1h-pyrrol-1-ylamine, C11H13NO5S, CID257476,

Complexity	396
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	271.051g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	271.287g/mol
Monoisotopic Mass	271.051g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	92.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

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