AG003B2P

4273-98-7 | 2-(Phenylsulfonyl)Aniline

AG003B2P

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CAS Number	4273-98-7
Catalog Number	AG003B2P(AGN-PC-0WA5DV)
Chemical Name	2-(Phenylsulfonyl)Aniline
EC Number	224-271-1
IUPAC Name	2-(benzenesulfonyl)aniline
InChI	InChI=1S/C12H11NO2S/c13-11-8-4-5-9-12(11)16(14,15)10-6-2-1-3-7-10/h1-9H,13H2
InChI Key	JBCUKQQIWSWEOK-UHFFFAOYSA-N
MDL Number	MFCD00007706
Molecular Formula	C12H11NO2S
Molecular Weight	233.2862
SMILES	NC1=C(C=CC=C1)S(=O)(=O)C1=CC=CC=C1
UNII	6VU39ID7LU
Synonyms	2-(Phenylsulfonyl)aniline, 4273-98-7, 2-Amino diphenyl sulfone, 2-Aminophenyl phenyl sulfone, 2-Aminodiphenylsulfone, 2-(benzenesulfonyl)aniline, Benzenamine, 2-(phenylsulfonyl)-, o-Aminodiphenyl sulfone, 2-Aminodiphenyl sulfone, UNII-6VU39ID7LU, 6VU39ID7LU, JBCUKQQIWSWEOK-UHFFFAOYSA-N, AK110734, 2-(phenylsulfonyl)phenylamine, W-106264, NSC624235, 2-Aminophenyl phenyl sulphone, aminodiphenylsulfone, EINECS 224-271-1, 2-Aminodiphenylsulfon, 2-phenylsulfonylaniline, PubChem10857, ACMC-209jqv, 2NHPh-SO2-Ph, AC1Q6USP, 2-(Phenylsulphonyl)aniline, 2-benzenesulfonylphenylamine, AC1L2U6K, DSSTox_CID_24941, DSSTox_RID_80605, DSSTox_GSID_44941, 2-(phenylsulfonyl)benzenamine, KSC497S4D, BIDD:GT0551, SCHEMBL395274, CHEMBL2009408, DTXSID0044941, Benzenamine,2-(phenylsulfonyl)-, CTK3J7941, JBCUKQQIWSWEOK-UHFFFAOYSA-, KS-00000UUF, 2-(Phenylsulfonyl)aniline, 97%, ZINC119995, ZX-AT007422, Tox21_301626, ANW-29861, MFCD00007706, OR9876, SBB000718, AKOS003272966, ACM4273987, MCULE-6747622716, PS-6279, RP28074, VZ23505, NCGC00256301-01, AC-10749, AJ-11649, NCI60_007288, ZB004051, CAS-4273-98-7, AX8013830, RT-004100, TL8006866, FT-0610999, ST24039712, ST50984721, C-13700, I01-2641, InChI=1/C12H11NO2S/c13-11-8-4-5-9-12(11)16(14,15)10-6-2-1-3-7-10/h1-9H,13H2, 2- aniline, C12H11NO2S, 2-Benzenesulfonyl-phenylamine, Aniline, o-(phenylsulfonyl)-, CID77956, C12-H11-N-O2-S, AR-1C9703, 2-(Phenylsulfonyl)aniline hydrochloride, C.I.37060, A1857, 462-94-2,

Complexity	314
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	233.051g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	233.285g/mol
Monoisotopic Mass	233.051g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	68.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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