AG003ROG

33045-52-2 | Methyl 2-methoxy-5-sulfamoylbenzoate

AG003ROG

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CAS Number	33045-52-2
Catalog Number	AG003ROG(AGN-PC-0JLLSZ)
Chemical Name	Methyl 2-methoxy-5-sulfamoylbenzoate
EC Number	251-358-1
IUPAC Name	methyl 2-methoxy-5-sulfamoylbenzoate
InChI	InChI=1S/C9H11NO5S/c1-14-8-4-3-6(16(10,12)13)5-7(8)9(11)15-2/h3-5H,1-2H3,(H2,10,12,13)
InChI Key	MKDYDRQLKPGNNU-UHFFFAOYSA-N
MDL Number	MFCD00296976
Molecular Formula	C9H11NO5S
Molecular Weight	245.2523
SMILES	O=C(OC)C1=CC(S(=O)(N)=O)=CC=C1OC
Synonyms	Methyl 2-methoxy-5-sulfamoylbenzoate, 33045-52-2, Methyl 5-(Aminosulfonyl)-2-methoxybenzoate, 2-Methoxy-5-sulfamoylbenzoic Acid Methyl Ester, Methyl 5-sulfamoyl-o-anisate, 5-Aminosulfonyl-2-methoxybenzoic acid methyl ester, Benzoic acid, 5-(aminosulfonyl)-2-methoxy-, methyl ester, Methyl 5-sulphamoyl-o-anisate, Methyl2-methoxy-5-sulfamoylbenzoate, EINECS 251-358-1, Sulpiride Impurity B, AC1Q6UIF, ACMC-209hy2, AC1L3MU5, DSSTox_CID_31507, DSSTox_RID_97392, DSSTox_GSID_57718, SCHEMBL330293, Jsp006080, CHEMBL3560556, DTXSID4057718, CTK4G9808, KS-00000BIC, MKDYDRQLKPGNNU-UHFFFAOYSA-N, ZINC403396, BCP24519, Tox21_113746, ANW-27528, BBL034810, MFCD01317542, SBB066414, STL416207, AKOS005216563, methyl 2-methoxy-5-sulfamoyl-benzoate, Methyl 2-Methoxy-5-sulphamoylbenzoate, AB08554, MCULE-4782029881, PS-7531, RL03190, TRA0000929, VZ32551, Methyl 2-methoxy-5-aminosulfonylbenzoate, NCGC00253616-01, AJ-22075, CJ-03868, SY009661, ZB013205, CAS-33045-52-2, DB-048323, Methyl 2-methoxy-5-sulfamoylbenzoate, 98%, ST2419529, TC-116273, TL8002493, FT-0639077, M1942, MFCD01317542 (97%), M-1645, 2-methoxy-5-sulfamoyl benzoic acid methyl ester, 045M522, SR-01000944812, SR-01000944812-1, W-106794, 5-(Aminosulfonyl)-2-methoxybenzoic Acid Methyl Ester, Z17862399, Benzoic acid,5-(aminosulfonyl)-2-methoxy-, methyl ester, Sulpiride impurity B, European Pharmacopoeia (EP) Reference Standard, C9H11NO5S, C9-H11-N-O5-S, AR-1J4816, CID118390, 2-methoxy-5-sulfamide methyl benzoate?, 2-methoxy-5-aminosulfonyl-methyl benzoate, 2-METHOXY-5-SULFAMOYL METHYL BENZOATE, 33990-32-8,

Complexity	347
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	245.036g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	245.249g/mol
Monoisotopic Mass	245.036g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	104A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

Lot Number