AG0059P3

747-36-4 | Hydroxychloroquine sulfate

AG0059P3

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CAS Number	747-36-4
Catalog Number	AG0059P3(AGN-PC-0U5Z6Q)
Chemical Name	Hydroxychloroquine sulfate
EC Number	212-019-3
IUPAC Name	2-[4-[(7-chloroquinolin-4-yl)amino]pentyl-ethylamino]ethanol;sulfuric acid
InChI	InChI=1S/C18H26ClN3O.H2O4S/c1-3-22(11-12-23)10-4-5-14(2)21-17-8-9-20-18-13-15(19)6-7-16(17)18;1-5(2,3)4/h6-9,13-14,23H,3-5,10-12H2,1-2H3,(H,20,21);(H2,1,2,3,4)
InChI Key	JCBIVZZPXRZKTI-UHFFFAOYSA-N
MDL Number	MFCD00078203
Molecular Formula	C18H28ClN3O5S
Molecular Weight	433.9500
SMILES	CCN(CCO)CCCC(NC1=CC=NC2=CC(Cl)=CC=C12)C.O=S(O)(O)=O
Synonyms	Hydroxychlorochin, Hydroxychloroquine, Hydroxychloroquine Sulfate, Hydroxychloroquine Sulfate (1:1) Salt, Oxychlorochin, Oxychloroquine, Plaquenil, HYDROXYCHLOROQUINE SULFATE, 747-36-4, Hydroxychloroquine sulphate, Ercoquin, Plaquinol, Toremonil, 2-((4-((7-Chloroquinolin-4-yl)amino)pentyl)(ethyl)amino)ethanol sulfate, HCQ sulfate, NSC 4375, Hydroxychloroquine sulfate [USP], TCMDC-123987, EINECS 212-019-3, AI3-52706, AK-72909, 2-((4-((7-Chloro-4-quinolinyl)amino)pentyl)ethylamino)ethanol sulfate (1:1) (salt), 2-((4-((7-Chloro-4-quinolyl)amino)pentyl)ethylamino)ethanol sulfate (1:1) (salt), DSSTox_CID_27788, DSSTox_RID_82563, Ethanol, 2-((4-((7-chloro-4-quinolinyl)amino)pentyl)ethylamino)-, sulfate (1:1) (salt), Ethanol, 2-((4-((7-chloro-4-quinolyl)amino)pentyl)ethylamino)-, sulfate (1:1) (salt), C18H28ClN3O5S, DSSTox_GSID_47811, W-104413, Hydroxychloroquine sulfate, 98%, 2-((4-(7-chloroquinolin-4-ylamino)pentyl)(ethyl)amino)ethanol sulfate, 2-((4-((7-chloroquinolin-4-yl)amino)pentyl)(ethyl)amino)ethan-1-ol sulfate, (+-)-2-((4-((7-Chloro-4-quinolyl)amino)pentyl)ethylamino)ethanol sulfate (1:1) (salt), 2-({4-[(7-chloroquinolin-4-yl)amino]pentyl}(ethyl)amino)ethan-1-ol; sulfuric acid, CAS-747-36-4, Ethanol, 2-((4-((7-chloro-4-quinolinyl)amino)pentyl)ethyl)amino-, (+-)-, sulfate (1:1) salt, Ethanol, 2-((4-((7-chloro-4-quinolinyl)amino)pentyl)ethylamino)-, sulfate (1:1), SR-05000001881, NCGC00159483-02, C18H26ClN3O.H2O4S, Plaquenil sulfate, 2-[4-[(7-chloroquinolin-4-yl)amino]pentyl-ethylamino]ethanol;sulfuric acid, 7-Chloro-4-[4-[ethyl-(2-hydroxyethyl)amino]-1-methylbutylamino]quinoline, Plaquenil (TN), Ethanol, monosulfate, MFCD00078203, Oxichlorochine Sulfate, PubChem15393, hydroxychloroquine-sulfate, AC1L20PB, CHEMBL1690, SCHEMBL41114, SPECTRUM1503978, HYDROXYCHLOROQINE SULFATE, DTXSID1047811, Hydroxychloroquine Sulfate ,(S), hydroxychloroquine; sulfuric acid, CTK8B4131, KS-00000GEU, Ethanol, sulfate (1:1) (salt), HMS1922O12, HMS2093O05, HMS3713J22, Pharmakon1600-01503978, BCP12823, HY-B1370, NSC-4375, Tox21_111707, ANW-43969, CCG-39154, NSC758663, s4430, Hydroxychloroquine sulfate (JAN/USP), AKOS015897337, Tox21_111707_1, API0025948, CS-8017, KS-5311, MCULE-4122662001, NSC-758663, SB19140, 7-Chloro-4-[4-[N-ethyl-N-(2-hydroxyethyl)amino]-1-methylbutylamino]quinoline Sulfate, N4-(7-Chloro-4-quinolyl)-N1-ethyl-N1-(2-hydroxyethyl)-1,4-pentanediamine Sulfate, NCGC00095090-01, NCGC00095090-02, NCGC00159483-04, AN-22118, BR-72909, CPD000525253, LS-66615, M567, SAM001246735, ACM1216432562, AB0015282, AX8134190, TR-024132, 4CH-007360, FT-0603511, ST24030764, Hydroxycloroquine sulfate, analytical standard, D02114, J10260, S-2011, 747H364, Hydroxychloroquine sulfate, >=98% (HPLC), powder, SR-05000001881-1, SR-05000001881-2, Z1551900864, Hydroxychloroquine Sulphate 1.0 mg/ml in Methanol (as free base), 2-((4-((7-Chloroquinolin-4-yl)amino)-pentyl)(ethyl)amino)ethanol sulfate, 2-[[4-[(7-Chloro-4-quinolinyl)amino]pentyl]ethylamino]ethanol sulfate, 2-[4-[(7-chloro-4-quinolyl)amino]pentyl-ethyl-amino]ethanol; sulfuric acid, 2-[4-[(7-chloroquinolin-4-yl)amino]pentyl-ethylamino]ethanol; sulfuric acid, Ethanol, 2-[[4-[(7-chloro-4-quinolinyl)amino]pentyl]ethyl]amino]-, sulfate (1:1) (salt), Hydroxychloroquine Sulfate, Pharmaceutical Secondary Standard; Certified Reference Material, Hydroxychloroquine sulfate, United States Pharmacopeia (USP) Reference Standard, Ethanol, 2-((4-((7-chloro-4-quinolyl)amino)pentyl)ethylamino)-, sulfate (1:1) (salt) (8CI), Plaquenil, hydroxychloroquine, Hydroxychloroquinesulfate, UNII-8Q2869CNVH, Hydroxychloroquine-d4 Sulfate, 8Q2869CNVH, NSC4375, CID12947, RW2760, C18-H26-Cl-N3-O.H2-O4-S, H1306, Ethanol, 2-[[4-[(7-chloro-4-quinolinyl) amino]pentyl]ethylamino]-, sulfate (1:1) (salt), Ethanol, 2-[[4-[(7-chloro-4-quinolinyl)amino]pentyl]ethylamino]-, sulfate (1:1) (salt), Ethanol, 2-[[4-[(7-chloro-4-quinolyl)amino]pentyl]ethylamino]-, sulfate (1:1) (salt), 118-42-3, 1216432-56-2, HCQ,

Complexity	413
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	433.144g/mol
Formal Charge	0
Heavy Atom Count	28
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	433.948g/mol
Monoisotopic Mass	433.144g/mol
Rotatable Bond Count	9
Topological Polar Surface Area	131A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

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