AG007F2F

10405-02-4 | TROSPIUM CHLORIDE

AG007F2F

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CAS Number	10405-02-4
Catalog Number	AG007F2F(AGN-PC-04RNT2)
Chemical Name	TROSPIUM CHLORIDE
EC Number	233-875-4
IUPAC Name	[(1S,5R)-spiro[8-azoniabicyclo[3.2.1]octane-8,1'-azolidin-1-ium]-3-yl] 2-hydroxy-2,2-diphenylacetate;chloride
InChI	InChI=1S/C25H30NO3.ClH/c27-24(25(28,19-9-3-1-4-10-19)20-11-5-2-6-12-20)29-23-17-21-13-14-22(18-23)26(21)15-7-8-16-26;/h1-6,9-12,21-23,28H,7-8,13-18H2;1H/q+1;/p-1/t21-,22+,23?;
InChI Key	RVCSYOQWLPPAOA-DHWZJIOFSA-M
MDL Number	MFCD00865254
Molecular Formula	C25H30ClNO3
Molecular Weight	427.9636
SMILES	O(C(C(O)(C1=CC=CC=C1)C2=CC=CC=C2)=O)[C@@H]3C[C@]4([N+]5([C@@](C3)(CC4)[H])CCCC5)[H].[Cl-]
UNII	1E6682427E
Synonyms	azoniaspiro compound XVII, azoniaspiro(3 alpha-benziloyloxynortropane-8,1'- pyrrolidine) chloride, Ceris, Spasmex, Spasmo-lyt, Spasmo-Rhoival TC, Spasmo-Urgenin, Spasmo-Urgenin TC, Spasmolyt, Trospi, trospium chloride, Uraplex, Uraton, trospium chloride, Sanctura, 10405-02-4, Trospium (chloride), Spasmex, Spasmo-lyt, UNII-1E6682427E, Trospium chloride (Sanctura), Relaspium, Santura, Keptan, Azoniaspiro Compound XVII, IP631, Spasmo 3, AS Xvii, 1E6682427E, DSSTox_CID_3724, DSSTox_RID_77166, DSSTox_GSID_23724, Trospii chloridum [INN-Latin], Uraplex, Cloruro de trospio [INN-Spanish], Chlorure de trospium [INN-French], EINECS 233-875-4, Trospium Cl, Sanctura XR, Trospii chloridum, Cloruro de trospio, Spiro[8azoniabicyclo[3.2.1]octane-8,1'-pyrrolidinium], 3-[(hydroxydiphenylacetyl)oxy]-, chloride, (1, 3, 5);Spiro[8azoniabicyclo[3.2.1]octane-8,1'-pyrrolidinium], 3-[(hydroxydiphenylacetyl)oxy]-, chloride, (1, 3, 5), Chlorure de trospium, CAS-10405-02-4, NCGC00167438-01, NCGC00167438-02, Trospiumchlorid, 8-alpha-Benziloyloxy-6,10-ethano-5-azoniaspiro(4.5)decane chloride, Azoniaspiro(3-alpha-benziloyloxy-nortropan-8,1'-pyrrolidine)-chloride, [(1S,5R)-spiro[8-azoniabicyclo[3.2.1]octane-8,1'-azolidin-1-ium]-3-yl] 2-hydroxy-2,2-diphenylacetate;chloride, AC1NR4ST, Trospium chloride [USAN:USP:INN:BAN:JAN], SCHEMBL25785, CHEMBL3084748, DTXSID7023724, SCHEMBL13836646, 3alpha-Hydroxyspiro(1alphaH,5alphaH-nortropane-8,1'-pyrrolidinium) chloride benzilate, RVCSYOQWLPPAOA-QKYUOBHYSA-M, HMS3656C16, BCP23426, HY-B0461, Spiro (8-azoniabicyclo(3.2.1)octane-8,1'-pyrrolidinium), 3-((hydroxydiphenylacetyl)oxy)-, chloride, (1alpha, 3beta, 5alpha), Spiro(1-alpha-H,5-alpha-H-nortropane-8,1'-pyrrolidinium), 3-alpha-hydroxy-, chloride, benzilate, Spiro(8-azoniabicyclo(3.2.1)octane-8,1'-pyrrolidinium, 3-((hydroxydiphenylacetyl)oxy)-, chloride, (1alpha,3beta,5alpha)-, Tox21_112442, MFCD00865254, s2549, AKOS015833209, Tox21_112442_1, AC-4235, API0004533, CS-2572, BC209629, BCP0726000291, AB0000782, AB2000646, FT-0636699, ST24050330, SW219146-1, B-1868, A800884, W-108827, [(1R,5S)-spiro[8-azoniabicyclo[3.2.1]octane-8,1'-azolidin-1-ium]-3-yl] 2-hydroxy-2,2-diphenylacetate chloride, [(1S,5R)-spiro[8-azoniabicyclo[3.2.1]octane-8,1'-azolidin-1-ium]-3-yl] 2-oxidanyl-2,2-diphenyl-ethanoate chloride, 2-hydroxy-2,2-diphenylacetic acid [(1S,5R)-3-spiro[8-azoniabicyclo[3.2.1]octane-8,1'-azolidin-1-ium]yl] ester chloride, 3-((hydroxydiphenylacetyl)oxy)-spiro(8-azoniabicyclo(3.2.1)octane-8,1'-pyrrolidinium chloride, Trospium, Spasmolyt, Trospi, Uraton, Ceris, Spasmo-Urgenin, Spasmo-Rhoival TC, Spasmo-Urgenin TC, C25H30ClNO3, Trospium chloride [INN:JAN], C25-H30-N-O3.Cl, Trospium chloride, 98% - 1G 1g, CID5284631, B1616, T3305, C003330, azoniaspiro(3 alpha-benziloyloxynortropane-8,1'- pyrrolidine) chloride, 3-alpha-hydroxyspiro[1-alpha H,5-alpha H-nortropane-8,1'-pyrrolidinium] chloride benzilate, Spiro[1.alpha.H,5.alpha.H-nortropane-8,1'-pyrrolidinium], 3.alpha.-hydroxy-, chloride, benzilate, Spiro[8-azoniabicyclo[3.2.1]octane-8,1'-pyrrolidinium], 3-[(hydroxydiphenylacetyl)oxy]-, chloride, endo-,

Complexity	553
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	427.191g/mol
Formal Charge	0
Heavy Atom Count	30
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	427.969g/mol
Monoisotopic Mass	427.191g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	46.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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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