AG00IMIR

3695-00-9 | BENZENESULFONAMIDE, 4-METHYL-N-[(4-METHYLPHENYL)SULFONYL]-

AG00IMIR

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CAS Number	3695-00-9
Catalog Number	AG00IMIR(AGN-PC-0JLQL8)
Chemical Name	BENZENESULFONAMIDE, 4-METHYL-N-[(4-METHYLPHENYL)SULFONYL]-
EC Number	223-016-1
IUPAC Name	4-methyl-N-(4-methylphenyl)sulfonylbenzenesulfonamide
InChI	InChI=1S/C14H15NO4S2/c1-11-3-7-13(8-4-11)20(16,17)15-21(18,19)14-9-5-12(2)6-10-14/h3-10,15H,1-2H3
InChI Key	LHWZLUXODWUHLZ-UHFFFAOYSA-N
MDL Number	MFCD00014917
Molecular Formula	C14H15NO4S2
Molecular Weight	325.4032
NSC Number	1150
SMILES	O=S(C1=CC=C(C)C=C1)(NS(=O)(C2=CC=C(C)C=C2)=O)=O
Synonyms	Di-p-toluenesulfonamide, 3695-00-9, Bis(p-tolylsulfonyl)amine, 4-Methyl-N-tosylbenzenesulfonamide, ditosylamine, Di-p-Toluenesulfonimide, Bis(4-methylbenzenesulfon)amine, Benzenesulfonamide, 4-methyl-N-[(4-methylphenyl)sulfonyl]-, 4-methyl-N-(4-methylphenyl)sulfonylbenzenesulfonamide, 4-Methyl-N-((4-methylphenyl)sulfonyl)benzenesulfonamide, Benzenesulfonamide, 4-methyl-N-((4-methylphenyl)sulfonyl)-, 4-methyl-N-[(4-methylphenyl)sulfonyl]benzenesulfonamide, NSC1150, NSC 1150, EINECS 223-016-1, Di-P-Toluenesulphonamide, AC1L2SPU, AC1Q2LPR, N-[(p-tolylsulphonyl]-p-toluenesulphonamide, 4-TOLUENESULFIMIDE, Bis(p-toluenesulfonyl)amine, AC1Q6U8O, SCHEMBL187561, DTXSID6063141, CTK4H7442, Bis(4-methylbenzenesulfonyl)amine, ZINC397599, bis[(4-methylphenyl)sulfonyl]amine, NSC-1150, MFCD00014917, AKOS024319333, ACM3695009, MCULE-5681570904, VZ35578, AN-20936, ZB012717, N-(p-Tolylsulphonyl)-p-toluenesulphonamide, FT-0717316, M2975, ST50410659, 4-methyl-N-(p-tolylsulfonyl)benzenesulfonamide, C-52339, I14-63413, Benzenesulfonamide,4-methyl-N-[(4-methylphenyl)sulfonyl]-, 4-methyl-N-[(4-methylbenzene)sulfonyl]benzene-1-sulfonamide, Bis(4-methylbenzenesulfonyl)amine / Bis(p-toluenesulfonyl)amine / Bis(p-tolylsulfonyl)amine / Ditosylamine, C14H15NO4S2, CID77279, AR-1I0476, C14-H15-N-O4-S2, 38770-23-9,

Complexity	479
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	325.044g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	325.397g/mol
Monoisotopic Mass	325.044g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	97.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H303-H319
Packing Group
Precautionary statements	P264-P280-P305+P351+P338-P312-P337+P313
UN Code

Certificate of Analysis

Lot Number