AG0024NT

17639-64-4 | 1H-Pyrrole, 1-[(4-methylphenyl)sulfonyl]-

AG0024NT

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CAS Number	17639-64-4
Catalog Number	AG0024NT(AGN-PC-0JU73J)
Chemical Name	1H-Pyrrole, 1-[(4-methylphenyl)sulfonyl]-
IUPAC Name	1-(4-methylphenyl)sulfonylpyrrole
InChI	InChI=1S/C11H11NO2S/c1-10-4-6-11(7-5-10)15(13,14)12-8-2-3-9-12/h2-9H,1H3
InChI Key	OXWIEWFMRVJGNY-UHFFFAOYSA-N
MDL Number	MFCD00145014
Molecular Formula	C11H11NO2S
Molecular Weight	221.2755
SMILES	C1(=CC=C(C=C1)S(=O)(=O)N1C=CC=C1)C
Synonyms	1-Tosylpyrrole, 17639-64-4, 1-tosyl-1H-pyrrole, 1-(p-Toluenesulfonyl)pyrrole, N-Tosylpyrrole, 1-[(4-methylphenyl)sulfonyl]-1H-pyrrole, 1-(p-Tolylsulfonyl)pyrrole, 1-Tosyl-Pyrrole, 1-(4-Methylphenylsulfonyl)pyrrole, CHEMBL508732, 1H-pyrrole, 1-[(4-methylphenyl)sulfonyl]-, 1-(4-methylphenyl)sulfonylpyrrole, OXWIEWFMRVJGNY-UHFFFAOYSA-N, MFCD00145014, AK-60366, N-Tosylpyrrole, 98%, CBMicro_017007, 1-Tosyl Pyrrole, zlchem 1041, AC1LCZXE, 1-tosyl-1-H-pyrrole, Cambridge id 5126265, 1-(4-Tolylsulfonyl)pyrrole, ACMC-1C77N, N-(p-Toluenesulfonyl)pyrrole, SCHEMBL1364805, 1-p-toluenesulfonyl-1H-pyrrole, Jsp003629, CTK4D6204, DTXSID80348694, ZLD0507, [(4-methylphenyl)sulfonyl]pyrrole, ZINC403153, 1-(4-methylbenzenesulfonyl)pyrrole, 1-(p-Tolylsulfonyl)pyrrole, 97%, CCG-5047, ZX-AT012289, 1-(Toluene-4-sulfonyl)-1H-pyrrole, ANW-22823, BDBM50266686, CT-604, HTS006949, STK366627, 1-[(4-Methylbenzene)sulfonyl]pyrrole, AKOS003270574, BS-4298, MCULE-5938664651, OR11477, 1-(4-methylbenzenesulfonyl)-1H-pyrrole, ACM17639644, AJ-21953, CC-02494, CJ-03808, SC-87604, ST097251, 1-(p-Toluenesulfonyl)pyrrole1-Tosylpyrrole, BIM-0016960.P001, 1H-Pyrrole,1-[(4-methylphenyl)sulfonyl]-, AB0053805, AX8013030, DB-044259, TR-008040, CS-0037471, FT-0637577, ST24027171, V3830, AZ0001-0219, B-2254, 611T408, C-12294, I01-2879, J-011187, InChI=1/C11H11NO2S/c1-10-4-6-11(7-5-10)15(13,14)12-8-2-3-9-12/h2-9H,1H, C11H11NO2S, CID640087, ACN-051497, 1-((4-methylphenyl)sulfonyl)-1h-pyrrole, T1386,

Complexity	293
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.051g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	221.274g/mol
Monoisotopic Mass	221.051g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	47.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

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