Heteronium Bromide

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For Research Use Only | Not For Clinical Use
CATAPS7247576
CAS7247-57-6
Structure
SynonymsHetrum Bromide,Pyrrolidinium, 3-[[2-hydroxy-2-phenyl-2-(2-thienyl)acetyl]oxy]-1,1-dimethyl-, bromide (1:1), Heteronium bromide, Pyrrolidinium, 3-[(hydroxyphenyl-2-thienylacetyl)oxy]-1,1-dimethyl-, bromide (9CI), Pyrrolidinium, 3-hydroxy-1,1-dimethyl-, bromide, alpha-phenyl-2-thiopheneglycolate (8CI), 31814, (+/-)-Heteronium bromide, 3-Hydroxy-1,1-dimethylpyrrolidinium bromide, alpha-phenyl-2-thiopheneglycolate (7CI)
IUPAC Name(1,1-dimethylpyrrolidin-1-ium-3-yl) 2-hydroxy-2-phenyl-2-thiophen-2-ylacetate;bromide
Molecular Weight412.34
Molecular FormulaC18H22NO3S.Br
Canonical SMILES[Br-].C[N+]1(C)CCC(C1)OC(=O)C(O)(c2ccccc2)c3cccs3
InChIInChI=1S/C18H22NO3S.BrH/c1-19(2)11-10-15(13-19)22-17(20)18(21,16-9-6-12-23-16)14-7-4-3-5-8-14;/h3-9,12,15,21H,10-11,13H2,1-2H3;1H/q+1;/p-1
Accurate Mass411.0504
API FamilyMatrix - API Family Heteronium Bromide
FormatNeat
Product TypeAPI
ShippingRoom Temperature
Storage Conditions+5°C
SubcategoryMikromol, API standards
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