AG00IBTF

68291-97-4 | 1,​2-​Benzisoxazole-​3-​methanesulfonamide

AG00IBTF

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CAS Number	68291-97-4
Catalog Number	AG00IBTF(AGN-PC-07A28O)
Chemical Name	1,​2-​Benzisoxazole-​3-​methanesulfonamide
EC Number	614-395-8
IUPAC Name	1,2-benzoxazol-3-ylmethanesulfonamide
InChI	InChI=1S/C8H8N2O3S/c9-14(11,12)5-7-6-3-1-2-4-8(6)13-10-7/h1-4H,5H2,(H2,9,11,12)
InChI Key	UBQNRHZMVUUOMG-UHFFFAOYSA-N
MDL Number	MFCD00865316
Molecular Formula	C8H8N2O3S
Molecular Weight	212.2257
SMILES	O=S(CC1=NOC2=C1C=CC=C2)(N)=O
UNII	459384H98V
Synonyms	3 Sulfamoylmethyl 1,2 benzisoxazole, 3-sulfamoylmethyl-1,2-benzisoxazole, AD 810, AD-810, AD810, CI 912, CI-912, CI912, Zonegran, zonisamide, zonisamide monosodium, zonisamide, 68291-97-4, Zonegran, 1,2-Benzisoxazole-3-methanesulfonamide, Exceglan, Excegram, 1,2-benzoxazol-3-ylmethanesulfonamide, Zonisamida, Zonisamidum, Zonisamidum [Latin], Zonisamida [Spanish], Excegran, AD-810, CI-912, 3-(Sulfamoylmethyl)-1,2-benzisoxazole, AD 810, CI 912, benzo[d]isoxazol-3-ylmethanesulfonamide, PD 110843, Benzo[d]isoxazol-3-yl-methanesulfonamide, HSDB 7293, PD-110843, 1-(1,2-Benzoxazol-3-Yl)methanesulfonamide, UNII-459384H98V, BRN 1077076, SPR_2, C8H8N2O3S, 1-(1,2-benzisoxazol-3-yl)methanesulfonamide, UBQNRHZMVUUOMG-UHFFFAOYSA-N, 1-(1,2-BENZOXAZOL-3-YL)METHANESULPHONAMIDE, NCGC00159319-02, NCGC00159319-04, 459384H98V, DSSTox_CID_26023, DSSTox_RID_81296, DSSTox_GSID_46023, Tremode, Trerief, Excegran (TN), SMR000596519, Zonisamide (ZNS), CAS-68291-97-4, Zonisamide [USAN:BAN:INN:JAN], SR-01000837537, 3-sulfamoylmethyl-1,2-benzisoxazole, Zonisamide (JAN/USAN/INN), Zonisamide, ZNS, AD-810N, Zonisamide, 1, MFCD00865316, Zonisamide [USAN:USP:INN:BAN:JAN], AC1L1L0Q, AC1Q55GQ, BIDD:PXR0183, SCHEMBL35458, MLS001195632, MLS001306491, BIDD:GT0708, GTPL7047, ZINC4321, DTXSID9046023, BDBM10888, CTK5C7726, EBD1748, HMS2089O07, HMS2235L13, HMS3259N09, HMS3269F21, HMS3657E03, HMS3677L09, HMS3714E19, Zonisamide 1.0 mg/ml in Methanol, BCP28480, HY-B0124, KS-000011XD, Tox21_111569, BBL010040, s1445, SBB070483, STK711131, AKOS001312269, Tox21_111569_1, AC-1413, CCG-220669, CS-1888, DB00909, KS-1142, MCULE-1873297847, NC00637, NE51071, VA11961, 1,2-Benzisoxazol-3-ylmethanesulfonamide, (1,2-benzoxazol-3-yl)methanesulfonamide, NCGC00159319-03, AK481296, AN-14974, BC208866, CPD000596519, LS-33637, SAM002548957, SC-46512, ZB000571, AB0012361, AB2000114, TC-030637, FT-0082702, FT-0601524, SW199135-2, EN300-50288, C07504, D00538, J90034, 1,2-Benzisoxazole-3-methanesulfonic acid; Amide, 68291-97-4,68291-98-5(sodiumsalt), AB00876297-09, AB00876297-10, AB00876297_11, Zonisamide pound>>CI-912 pound>>PD 110843, 291Z974, A836085, I06-0495, Q-201948, SR-01000837537-2, SR-01000837537-3, SR-01000837537-8, BRD-K48300629-001-03-8, Z223042524, Zonisamide solution, 1.0 mg/mL in methanol, ampule of 1 mL, certified reference material, Aleviatin, zonisamide monosodium, Zonegran (TN), Zonegran, Zonisamide, Elan brand of zonisamide, AD 810 (sulfonamide), CHEMBL750, D09ZIS, CHEBI:10127, CID5734, AD810, CI912, C8-H8-N2-O3-S, Zonisamide [USAN:INN:BAN:JAN], 3 Sulfamoylmethyl 1,2 benzisoxazole, 3-(Sulfamoylmethyl)-1 2-benzisoxazole, CS-O-11773, (1 2-Benzisoxazol-3-yl)methanesulfonamide, E-2090, (1,2-Benzisoxazol-3-il) metanesulfonamide, A5354, Z0026, C022189, D000078305, 68291-98-5, ZON,

Complexity	298
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	212.026g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	212.223g/mol
Monoisotopic Mass	212.026g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	94.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H332
Packing Group
Precautionary statements	P280
UN Code	\N

Certificate of Analysis

Lot Number