AG00BPQM

25319-98-6 | 3,5-dichloro-4-hydroxybenzenesulphonic acid

AG00BPQM

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CAS Number	25319-98-6
Catalog Number	AG00BPQM(AGN-PC-0JLZ5X)
Chemical Name	3,5-dichloro-4-hydroxybenzenesulphonic acid
EC Number	246-833-5
IUPAC Name	3,5-dichloro-4-hydroxybenzenesulfonic acid
InChI	InChI=1S/C6H4Cl2O4S/c7-4-1-3(13(10,11)12)2-5(8)6(4)9/h1-2,9H,(H,10,11,12)
InChI Key	PGDCAFRJYQICAY-UHFFFAOYSA-N
MDL Number	MFCD00024959
Molecular Formula	C6H4Cl2O4S
Molecular Weight	243.0646
NSC Number	202726
SMILES	O=S(C1=CC(Cl)=C(O)C(Cl)=C1)(O)=O
Synonyms	3,5-dichloro-4-hydroxybenzenesulfonic acid, 25319-98-6, 3,5-Dichloro-4-hydroxybenzenesulphonic acid, 3,5-Dichloro-4-Hydroxybenzene-1-Sulfonic Acid, C6H4Cl2O4S, EINECS 246-833-5, NSC202726, AC1L3LZJ, AC1Q3M0Z, AC1Q78BS, SCHEMBL3857115, CTK4F5474, DTXSID70179959, ZINC1737176, 2033AB, AKOS016010390, FCH1329185, MCULE-4504458389, NSC-202726, ACM25319986, AJ-31359, AX8082511, 3,5-dichloro-4-hydroxybenzene sulfonic acid, FT-0710026, Benzenesulfonic acid,3,5-dichloro-4-hydroxy-, 6OR, C6-H4-Cl2-O4-S, CID91397, AR-1E9580, 3,5-dichloro-4-hydroxybenzenesulphonicacid, 25806-81-9,

Complexity	261
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	241.921g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	243.054g/mol
Monoisotopic Mass	241.921g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	83A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

Lot Number