AG001Y3R

16851-82-4 | 1H-Pyrrole, 1-(phenylsulfonyl)-

AG001Y3R

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CAS Number	16851-82-4
Catalog Number	AG001Y3R(AGN-PC-0JMR5J)
Chemical Name	1H-Pyrrole, 1-(phenylsulfonyl)-
EC Number	623-685-3
IUPAC Name	1-(benzenesulfonyl)pyrrole
InChI	InChI=1S/C10H9NO2S/c12-14(13,11-8-4-5-9-11)10-6-2-1-3-7-10/h1-9H
InChI Key	PPPXRIUHKCOOMU-UHFFFAOYSA-N
MDL Number	MFCD00067739
Molecular Formula	C10H9NO2S
Molecular Weight	207.2490
NSC Number	102019
SMILES	O=S(N1C=CC=C1)(C2=CC=CC=C2)=O
Synonyms	1-(Phenylsulfonyl)pyrrole, 16851-82-4, 1-(Phenylsulfonyl)-1H-pyrrole, N-Benzenesulphonylpyrrole, 1-(benzenesulfonyl)pyrrole, N-BENZENESULFONYLPYRROLE, 1-Benzenesulfonyl-1H-pyrrole, n-phenylsulfonylpyrrole, (phenylsulfonyl)pyrrole, 1H-Pyrrole, 1-(phenylsulfonyl)-, CHEMBL449256, 1H-Pyrrole,1-(phenylsulfonyl)-, PPPXRIUHKCOOMU-UHFFFAOYSA-N, GEO-02137, MFCD00067739, W-205974, 1-Phenylsulfonylpyrrole, phenylsulfonylpyrrole, NSC102019, 1benzenesulfonylpyrrole, 1-benzenesulfonylpyrrole, Maybridge3_000405, phenylsulfonyl-1H-pyrrole, ACMC-1C9JE, Phenyl 1-Pyrrolyl Sulfone, EC 623-685-3, AC1L3GC4, 1-benzensulfonyl-1H-pyrrole, SCHEMBL752816, 1-(benzenesulfonyl)-1H-pyrrole, 1-(phenylsulphonyl)-1H-pyrrole, CTK4D3020, KS-00000VYX, ZINC92362, DTXSID20168575, 1-(Phenylsulfonyl)pyrrole, 98%, HMS1432C09, 1-(Phenylsulfonyl)-1H-pyrrole #, 1-(Phenylsulfonyl)pyrrole_x000D_, BCP16980, ZX-AT023160, ANW-46138, BDBM50266635, SBB055784, STL191454, AKOS000522133, CCG-236339, CM10963, FCH1319581, LS41929, MCULE-6586737935, NSC-102019, OR21493, QC-1333, RP04615, TRA0061433, VP60052, IDI1_011792, AJ-10880, AK-33627, BP-10152, CC-02489, DS-12481, SC-65979, ZB003242, AX8012883, DB-043743, ST2403273, TC-134883, FT-0605861, P2095, ST50306856, W3673, C-10449, I11-1068, C10H9NO2S, CID140146, 1-(Phenylsulfonyl)pyrrole, 98% 1g, 1-(Phenylsulfonyl)pyrrole, 99% - 1G 1g,

Complexity	269
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	207.035g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	207.247g/mol
Monoisotopic Mass	207.035g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	47.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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