Basic information
- CAS
19864-71-2- Standard SMILES
CN(C)CCC[N+]1([O-])c2ccccc2CCc2ccccc21.Cl- InChIKey
WLJOEZWLZNMKMF-UHFFFAOYSA-N- Molecular formula
- C19H25ClN2O
- Average molar mass
- 332.9 g/mol
- Monoisotopic mass
- 332.1655411
Names & identifiers
- Preferred name
- N,N-Dimethyl-3-(5-oxo-10,11-dihydro-5H-5lambda~5~-dibenzo[b,f]azepin-5-yl)propan-1-amine--hydrogen chloride (1/1)
- IUPAC
- N,N-dimethyl-3-(11-oxido-5,6-dihydrobenzo[b][1]benzazepin-11-ium-11-yl)propan-1-amine;hydrochloride
- English name
- Imipraminoxide
- Molecular weight
- 0
Names & synonyms
DTXSID00941702N,N-Dimethyl-3-(5-oxo-10,11-dihydro-5H-5lambda~5~-dibenzo[b,f]azepin-5-yl)propan-1-amine--hydrogen chloride (1/1)ImiprexImipramine-N-oxide HClimipramine N-oxide chlorideImipramine-N-oxide hydrochlorideImipramine N-oxide hydrochloride5H-Dibenz(B,F)azepine, 5-(3-(dimethylamino)propyl)-10,11-dihydro-, 5-oxide, monohydrochloride
Database identifiers
- CAS
19864-71-2- PubChem CID
- 88286
- DTXSID
DTXSID00941702
Properties
Computed structural properties
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 333
Physicochemical properties
- FDA UNII
- 7396 L81U4 · R7396L81U4
- RIDADR
- 3249 · 3249
- HazardClass
- 6.1 · 6.1(b)
- PackingGroup
- III
- Toxicity
- 50 · mouse,LD50,intraperitoneal,150mg/kg (150mg/kg),United States Patent Document. Vol. #3574852,
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- ridadr
- 3249
- Toxicity
- mouse,LD50,intraperitoneal,150mg/kg (150mg/kg),United States Patent Document. Vol. #3574852,
- hazard_class
- 6.1(b)
- packing_group
- III
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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