Anisotropine methylbromide
CAS Registry Number®
80-50-2
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CAS Name
Anisotropine methylbromideMolecular Formula
C17H32NO2.BrCite this Page
Anisotropine methylbromide. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=80-50-2 (retrieved ) (CAS RN: 80-50-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
329 °C
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
InChI
InChI=1/C17H32NO2.BrH/c1-5-7-13(8-6-2)17(19)20-16-11-14-9-10-15(12-16)18(14,3)4;/h13-16H,5-12H2,1-4H3;1H/q+1;/p-1/t14-,15+,16+;
InChIKey
InChIKey=QSFKGMJOKUZAJM-CNKDKAJDNA-M
SMILES
C[N+]1(C)[C@]2(C[C@H](OC(C(CCC)CCC)=O)C[C@@]1(CC2)[H])[H].[Br-]
Canonical SMILES
[Br-].O=C(OC1CC2CCC(C1)[N+]2(C)C)C(CCC)CCC
Other Names for this Substance
- 8-Azoniabicyclo[3.2.1]octane, 8,8-dimethyl-3-[(1-oxo-2-propylpentyl)oxy]-, bromide, (3-endo)-
- 1αH,5αH-Tropanium, 3α-hydroxy-8-methyl-, bromide, 2-propylvalerate
- 8-Azoniabicyclo[3.2.1]octane, 8,8-dimethyl-3-[(1-oxo-2-propylpentyl)oxy]-, bromide, endo-
- 8-Methyltropinium bromide, 2-propylvalerate
- 8-Methyltropinium bromide 2-propylpentanoate
