AG003442

1694-06-0 | p-Toluenesulfonylurea

AG003442

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CAS Number	1694-06-0
Catalog Number	AG003442(AGN-PC-0JLBJJ)
Chemical Name	p-Toluenesulfonylurea
EC Number	216-900-3
IUPAC Name	(4-methylphenyl)sulfonylurea
InChI	InChI=1S/C8H10N2O3S/c1-6-2-4-7(5-3-6)14(12,13)10-8(9)11/h2-5H,1H3,(H3,9,10,11)
InChI Key	RUTYWCZSEBLPAK-UHFFFAOYSA-N
MDL Number	MFCD00196522
Molecular Formula	C8H10N2O3S
Molecular Weight	214.2416
SMILES	C1(=CC=C(C=C1)S(=O)(=O)NC(=O)N)C
Synonyms	4-tolylsulfonylurea, p-tolylsulfonylurea, 1694-06-0, n-carbamoyl-4-methylbenzenesulfonamide, 4-Methylphenylsulfonylurea, 4-Toluenesulfonylurea, 4-Tolylsulfonylurea, p-Toluenesulfonylurea, Benzenesulfonamide, N-(aminocarbonyl)-4-methyl-, AK-61005, EC-000.1456, amino-N-[(4-methylphenyl)sulfonyl]amide, N-(4-Toluenesulfonyl)urea, EINECS 216-900-3, p-toluenesulphonylurea, N-(p-Tolylsulfonyl)urea, p-Toluolsulfonyl-harnstoff, P-TOLYLSULFONYLUREA, N-(Aminocarbonyl)-4-methylbenzenesulphonamide, AC1L2LO7, AC1Q2LM8, (4-methylphenyl)sulfonylurea, Oprea1_528210, (4-methylbenzenesulfonyl)urea, SCHEMBL170426, AC1Q6U33, [(4-methylbenzene)sulfonyl]urea, CTK8B4303, DTXSID90168704, 4-toluenesulfonylurea, AldrichCPR, KS-000004UY, ZINC1081457, ANW-44641, MFCD00196522, SBB016984, AKOS003624899, DS-1957, FCH1319514, FS-3527, MCULE-2376375974, PB29041, RP15832, VZ29758, AJ-24964, AN-49711, CC-20486, CJ-04749, SC-16952, ZB015950, AB0011331, AX8005213, DB-043788, ST2419699, TC-133386, AM20030131, FT-0633778, ST50307489, C-8736, 694T060, C-11358, I01-1812, I14-6355, J-010537, J-523530, [(aminocarbonyl)amino](4-methylphenyl)dioxo-lambda~6~-sulfane, C8H10N2O3S, CID74327, C8-H10-N2-O3-S, AR-1K6559, ACN-048353, T2890, 468-20-2,

Complexity	299
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	214.041g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	214.239g/mol
Monoisotopic Mass	214.041g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	97.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

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

Lot Number