Basic information
- CAS
3833-87-2- Standard SMILES
C[NH+]1CCc2cccc3c2[C@@H]1Cc1ccc(F)cc1-3.[Cl-]- InChIKey
DFPOOSWSMBIVRQ-NTISSMGPSA-N- Molecular formula
- C17H17ClFN
- Average molar mass
- 289.8 g/mol
- Monoisotopic mass
- 289.1033554
Names & identifiers
- Preferred name
- Aporphine, 10-fluoro-, hydrochloride
- IUPAC
- (6aS)-10-fluoro-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium chloride
Names & synonyms
10-Fluoroaporphine hydrochlorideAPORPHINE, 10-FLUORO-, HYDROCHLORIDE4H-Dibenzo(de,g)quinoline, 10-fluoro-5,6,6a,7-tetrahydro-6-methyl-, hydrochloride3833-87-2RefChem:3199354H-Dibenzo(de,g)quinoline, 10-fluoro-5,6,6a,7-tetrahydro-6-methyl-, hydrochloride (9CI)
Database identifiers
- CAS
3833-87-2- PubChem CID
- 19685
Properties
Computed structural properties
- Topological polar surface area
- 4.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 344
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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