AG004THY

Name: 3-{4-[(methylamino)sulfonyl]phenyl}propanoic acid
Brand: Angene Chemical
SKU: AG004THY

842975-38-6 | 3-{4-[(methylamino)sulfonyl]phenyl}propanoic acid

AG004THY

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CAS Number	842975-38-6
Catalog Number	AG004THY(AGN-PC-0WA7Y4)
Chemical Name	3-{4-[(methylamino)sulfonyl]phenyl}propanoic acid
IUPAC Name	3-[4-(methylsulfamoyl)phenyl]propanoic acid
InChI	InChI=1S/C10H13NO4S/c1-11-16(14,15)9-5-2-8(3-6-9)4-7-10(12)13/h2-3,5-6,11H,4,7H2,1H3,(H,12,13)
InChI Key	RWDZHAQPBLATJP-UHFFFAOYSA-N
MDL Number	MFCD07186477
Molecular Formula	C10H13NO4S
Molecular Weight	243.2795
SMILES	O=C(O)CCC1=CC=C(S(=O)(NC)=O)C=C1
Synonyms	842975-38-6, 3-[4-(methylsulfamoyl)phenyl]propanoic acid, 3-(4-(N-Methylsulfamoyl)phenyl)propanoic acid, 3-(4-Methylsulfamoyl-phenyl)-propionic acid, 3-{4-[(METHYLAMINO)SULFONYL]PHENYL}PROPANOIC ACID, BAS 12384294, AC1MKR61, SCHEMBL5489381, CTK5F2172, DTXSID10390308, ZINC4488428, 2953AC, BBL002634, MFCD07186477, SBB067781, STK802681, AKOS000123947, MCULE-2359738389, AJ-51212, ST075558, TR-044480, FT-0655549, Y-2734, A840753, SR-01000368665, I14-5143, SR-01000368665-1, Z65519674, C10H13NO4S, 3-{4-[ sulfonyl]phenyl}propanoicacid, CID3161909,

Complexity	325
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	243.057g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	243.277g/mol
Monoisotopic Mass	243.057g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	91.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

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