AG000E2E

Name: 3-Ethanesulfonamidobenzoic Acid
Brand: Angene Chemical
SKU: AG000E2E

117292-19-0 | 3-Ethanesulfonamidobenzoic Acid

AG000E2E

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CAS Number	117292-19-0
Catalog Number	AG000E2E(AGN-PC-0JWSLM)
Chemical Name	3-Ethanesulfonamidobenzoic Acid
IUPAC Name	3-(ethylsulfonylamino)benzoic acid
InChI	InChI=1S/C9H11NO4S/c1-2-15(13,14)10-8-5-3-4-7(6-8)9(11)12/h3-6,10H,2H2,1H3,(H,11,12)
InChI Key	QTHHZXQBCFDQAL-UHFFFAOYSA-N
MDL Number	MFCD04090484
Molecular Formula	C9H11NO4S
Molecular Weight	229.2529
SMILES	CCS(NC1=CC(C(O)=O)=CC=C1)(=O)=O
Synonyms	3-ethanesulfonamidobenzoic acid, 3-[(ethylsulfonyl)amino]benzoic acid, 117292-19-0, Benzoic acid, 3-[(ethylsulfonyl)amino]-, 3-(ethylsulfonylamino)benzoic Acid, ACMC-20exlt, AC1LHEQE, AC1Q38DP, MLS000704589, SCHEMBL4191220, CHEMBL1701310, CTK0G0259, DTXSID30356906, QTHHZXQBCFDQAL-UHFFFAOYSA-N, HMS2744L23, ZINC363833, 3-ethanesulphonylamino-benzoic acid, AKOS000147178, MCULE-8646784877, NE57932, SC-57526, SMR000231593, Z7822, EN300-29790, BENZOIC ACID,3-[(ETHYLSULFONYL)AMINO]-, J-003551, Z53824998, C9H11NO4S, CID836756,

Complexity	320
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	229.041g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	229.25g/mol
Monoisotopic Mass	229.041g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	91.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

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