AG0035XH

39635-79-5 | 4,4'-Sulphonylbis(2,6-dibromophenol)

AG0035XH

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CAS Number	39635-79-5
Catalog Number	AG0035XH(AGN-PC-0JPR9M)
Chemical Name	4,4'-Sulphonylbis(2,6-dibromophenol)
EC Number	254-551-9
IUPAC Name	2,6-dibromo-4-(3,5-dibromo-4-hydroxyphenyl)sulfonylphenol
InChI	InChI=1S/C12H6Br4O4S/c13-7-1-5(2-8(14)11(7)17)21(19,20)6-3-9(15)12(18)10(16)4-6/h1-4,17-18H
InChI Key	JHJUYGMZIWDHMO-UHFFFAOYSA-N
MDL Number	MFCD00045741
Molecular Formula	C12H6Br4O4S
Molecular Weight	565.8546
SMILES	S(=O)(=O)(C1=CC(=C(C(=C1)Br)O)Br)C1=CC(=C(C(=C1)Br)O)Br
Synonyms	39635-79-5, 4,4'-Sulfonylbis(2,6-dibromophenol), 4,4'-Sulphonylbis(2,6-dibromophenol), Tetrabromobisphenol S, Phenol, 4,4'-sulfonylbis[2,6-dibromo-, 4,4'-Sulphonylbis[2,6-dibromophenol], Phenol, 4,4'-sulfonylbis(2,6-dibromo-, C12H6Br4O4S, CBDivE_002597, EINECS 254-551-9, Tetrabromo bisphenol S, CBDivE_005724, KSC680G1P, SCHEMBL312181, AC1L557O, DTXSID0052708, CTK5I0317, JHJUYGMZIWDHMO-UHFFFAOYSA-N, ZINC1232083, AC-934, MFCD00045741, STK365917, AKOS001030512, HCH0410713, LS40702, MCULE-7034170990, RL03519, VZ27512, 4,4'-Sulphonylbis(2,6-DiBioomophenol), 4,4\'-Sulphonylbis(2,6-Dibromophenol), AK140093, AN-15432, BC201527, O424, Phenol, 4,4'-sulfonylbis*2,6-dibromo-, AX8092354, DB-049448, FT-0639563, ST50036130, KS-00000286, 635T795, C-36596, I09-1218, J-514034, F0118-0005, 2,6-dibromo-4-(3,5-dibromo-4-hydroxy-phenyl)sulfonyl-phenol, 4,4 inverted exclamation marka-Sulfonylbis(2,6-dibromophenol), 4-[(3,5-dibromo-4-hydroxyphenyl)sulfonyl]-2,6-dibromophenol, 99290-18-3, 4,4'-Sulphonylbis, C12-H6-Br4-O4-S, CID170231, 4,4-Sulphonylbis(2,6-dibromophenol), N-(2,6-Dimethylphenyl)-2-picolinamide, 4,4/'-Sulphonylbis(2,6-dibromophenol), 2,6-dibromo-4-(3,5-dibromo-4-hydroxyphenyl)sulfonylphenol,

Complexity	408
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	565.668g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	565.852g/mol
Monoisotopic Mass	561.672g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	83A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 3077

Certificate of Analysis

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