AG005U1Q

98623-50-8 | 2-(1H-Indol-5-yl)-N-methylethanesulfonamide

AG005U1Q

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CAS Number	98623-50-8
Catalog Number	AG005U1Q(AGN-PC-00MPUH)
Chemical Name	2-(1H-Indol-5-yl)-N-methylethanesulfonamide
IUPAC Name	2-(1H-indol-5-yl)-N-methylethanesulfonamide
InChI	InChI=1S/C11H14N2O2S/c1-12-16(14,15)7-5-9-2-3-11-10(8-9)4-6-13-11/h2-4,6,8,12-13H,5,7H2,1H3
InChI Key	PPXMUBLAPJLGNE-UHFFFAOYSA-N
MDL Number	MFCD08458722
Molecular Formula	C11H14N2O2S
Molecular Weight	238.3061
SMILES	O=S(CCC1=CC2=C(NC=C2)C=C1)(NC)=O
Synonyms	98623-50-8, 2-(1H-Indol-5-yl)-N-methylethanesulfonamide, N-Methyl-1H-Indole-5-EthaneSulphonamide, N-Methyl-1H-indole-5-ethanesulfonamide, 2-(1H-indol-5-yl)-ethanesulfonic acid methylamide, PubChem21655, SCHEMBL1275476, CTK3I6471, DTXSID00541746, PPXMUBLAPJLGNE-UHFFFAOYSA-N, BCP16898, MFCD08458722, ZINC16698185, AKOS015917445, AN-5841, AJ-69485, 1H-Indole-5-ethanesulfonamide, N-methyl-, AX8145000, DB-003084, FT-0687515, ST24039083, 2-(1H-indol-5-yl)-N-methyl-ethanesulfonamide, 2-(1H-Indol-5-yl)-N-methylethane-1-sulfonamide, 623M508, I14-9540, N-Methyl-1H-indole-5-ethanesulfonamide (2-(1H-Indol-5-yl)-N-methylethanesulfonamide), n-methyl-1h-indole-5-ethane sulfonamide,

Complexity	323
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	238.078g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	238.305g/mol
Monoisotopic Mass	238.078g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	70.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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