AG00B5YA

17328-16-4 | N,N'-[Sulfonylbis(1,4-phenylene)]bis(chloroacetamide)

AG00B5YA

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CAS Number	17328-16-4
Catalog Number	AG00B5YA(AGN-PC-0JLWJM)
Chemical Name	N,N'-[Sulfonylbis(1,4-phenylene)]bis(chloroacetamide)
IUPAC Name	2-chloro-N-[4-[4-[(2-chloroacetyl)amino]phenyl]sulfonylphenyl]acetamide
InChI	InChI=1S/C16H14Cl2N2O4S/c17-9-15(21)19-11-1-5-13(6-2-11)25(23,24)14-7-3-12(4-8-14)20-16(22)10-18/h1-8H,9-10H2,(H,19,21)(H,20,22)
InChI Key	SHRCVZJKZJGIHQ-UHFFFAOYSA-N
MDL Number	MFCD00028183
Molecular Formula	C16H14Cl2N2O4S
Molecular Weight	401.2644
NSC Number	30176
SMILES	O=S(C1=CC=C(NC(CCl)=O)C=C1)(C2=CC=C(NC(CCl)=O)C=C2)=O
Synonyms	17328-16-4, TC-E 5003, Sulfone, bis((4-chloroacetylamino)phenyl), NSC30176, NSC 30176, BRN 2180613, 4',4'''-Sulfonylbis(beta-chloracetanilide), CHEMBL1797447, N,N'-[Sulfonylbis(4,1-phenylene)]bis(2-chloroacetamide), 2-chloro-N-[4-[4-[(2-chloroacetyl)amino]phenyl]sulfonylphenyl]acetamide, N,N'-(Sulfonylbis(4,1-phenylene))bis(2-chloroacetamide), AC1L3CUF, 4-(2,2-DICHLOROACETAMIDO)PHENYL SULFONE, SCHEMBL10996832, CTK8H2526, AOB2227, DTXSID40169569, ZINC1656284, BDBM50346713, MFCD00028183, NSC-30176, AKOS024431411, MCULE-6265511010, Acetanilide,4'''-sulfonylbis[2-chloro-, AS-16732, SY233006, LS-147964, NSC-30176 (TC-E5003), B7750, 4',4'''-Sulfonylbis(alpha-chloroacetanilide), Acetanilide, 4',4'''-sulfonylbis(2-chloro-, MFCD00028183 (95%), 4',4'''-Sulfonylbis(.beta.-chloracetanilide), A16378, 4',4''-SULFONYLBIS(2-CHLOROACETANILIDE), J-010894, Acetamide,N'-(sulfonyldi-4,1-phenylene)bis[2-chloro-, Acetanilide, 4',4'''-sulfonylbis(2-chloro- (8CI), N,N'-(Sulfonyldi-4,1-phenylene)bis(2-chloroacetamide), N,N'-[Sulfonylbis(1,4-phenylene)]bis(chloroacetamide), Acetamide, N,N'-(sulfonyldi-4,1-phenylene)bis(2-chloro-, Acetamide, N,N'-(sulfonyldi-4,1-phenylene)bis(2-chloro- (9CI), N,N inverted exclamation mark -[Sulfonylbis(4,1-phenylene)]bis(2-chloroacetamide), C16H14Cl2N2O4S, CID87052, C16-H14-Cl2-N2-O4-S, 4-13-00-01361 (Beilstein Handbook Reference), Acetanilide, 4',4'''-sulfonylbis[2-chloro-, Acetamide, N,N'-(sulfonyldi-4,1-phenylene)bis[2-chloro-,

Complexity	519
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	400.005g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	401.258g/mol
Monoisotopic Mass	400.005g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	101A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

Certificate of Analysis

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