AG005JDK

7454-54-8 | 4-Bromo-N-phenylbenzenesulfonamide

AG005JDK

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CAS Number	7454-54-8
Catalog Number	AG005JDK(AGN-PC-0JSYOQ)
Chemical Name	4-Bromo-N-phenylbenzenesulfonamide
IUPAC Name	4-bromo-N-phenylbenzenesulfonamide
InChI	InChI=1S/C12H10BrNO2S/c13-10-6-8-12(9-7-10)17(15,16)14-11-4-2-1-3-5-11/h1-9,14H
InChI Key	ZCUJCYISOKHAAW-UHFFFAOYSA-N
MDL Number	MFCD01136685
Molecular Formula	C12H10BrNO2S
Molecular Weight	312.1823
SMILES	BrC1=CC=C(C=C1)S(=O)(=O)NC1=CC=CC=C1
Synonyms	4-Bromo-N-phenylbenzenesulfonamide, 7454-54-8, N-[(4-Bromophenyl)sulfonyl]-aniline, ZCUJCYISOKHAAW-UHFFFAOYSA-N, 4-Bromo-N-phenyl-benzenesulfonamide, AC1LBU0N, 4-Bromobenzenesulfonanilide, ACMC-209ov4, AC1Q6TV0, CHEMBL179937, SCHEMBL1857218, CTK2H0009, DTXSID70340364, N-phenyl p-bromobenzenesulfonamide, N-phenyl-4-bromo-benzenesulfonamide, ZINC5214416, [(4-bromophenyl)sulfonyl]phenylamine, 4-Bromo-N-phenylbenzenesulfonamide #, ANW-36494, KM4013, MFCD01136685, STK402130, AKOS003249752, Benzenesulfonamide, 4-bromo-N-phenyl-, MCULE-4918202284, AJ-53614, SC-56380, TC-125239, CS-0060559, ST50912617, V7581, C12H10BrNO2S, AR-1K3098, CID564228, ZINC05214416, N-CYCLOHEXYL 4-BROMOBENZENESULFONAMIDE, 7454-76-4, 1643-21-6,

Complexity	325
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	310.962g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	312.181g/mol
Monoisotopic Mass	310.962g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	54.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

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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