Basic information
- CAS
25129-25-3- Standard SMILES
CC(=O)OC1CC2CCC(C1)N2C.Cl- InChIKey
ZGVUNVOYBBLNBW-UHFFFAOYSA-N- Molecular formula
- C10H18ClNO2
- Average molar mass
- 219.71 g/mol
- Monoisotopic mass
- 219.1026065
Names & identifiers
- Preferred name
- Acetyltropeine hydrochloride
- IUPAC
- (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) acetate;hydrochloride
Names & synonyms
Tropine acetate hydrochlorideAcetyltropeine HClAcetyltropeine hydrochloride25129-25-3DF 2581-alpha-H,5-alpha-H-Tropan-3-alpha-ol, acetate, hydrochloride8-Azabicyclo(3.2.1)octan-3-ol, 8-methyl-, acetate (ester), hydrochloride, endo-RefChem:3170288-Azabicyclo(3.2.1)octan-3-ol, 8-methyl-, acetate (ester), hydrochloride, endo-(9CI)8-Azabicyclo[3.2.1]octan-3-ol, 8-methyl-, acetate (ester), hydrochloride, endo- (9CI)DTXSID509479918-Methyl-8-azabicyclo[3.2.1]octan-3-yl acetate--hydrogen chloride (1/1)
Database identifiers
- CAS
25129-25-3- PubChem CID
- 212840
- DTXSID
DTXSID50947991
Properties
Computed structural properties
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 203
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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