Ketone, tert-butylaminoacetyl (10,11-dihydro-5H-dibenz(b,f)azepin-5-yl), hydrochloride
Basic information
- CAS
29456-76-6- Standard SMILES
CC(C)(C)[NH2+]CC(=O)N1c2ccccc2CCc2ccccc21.[Cl-]- InChIKey
YDUVNCVFHOFCBV-UHFFFAOYSA-N- Molecular formula
- C20H25ClN2O
- Average molar mass
- 344.9 g/mol
- Monoisotopic mass
- 344.1655411
Names & identifiers
- Preferred name
- Ketone, tert-butylaminoacetyl (10,11-dihydro-5H-dibenz(b,f)azepin-5-yl), hydrochloride
- IUPAC
- tert-butyl-[2-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-oxoethyl]azanium chloride
Names & synonyms
Ketone, tert-butylaminoacetyl (10,11-dihydro-5H-dibenz(b,f)azepin-5-yl), hydrochloride5H-Dibenz(b,f)azepine, 10,11-dihydro-5-(tert-butylaminoacetyl)-, hydrochloride5H-Dibenz(b,f)azepine, 5-(tert-butylaminoacetyl)-10,11-dihydro-, hydrochloride29456-76-6RefChem:350500
Database identifiers
- CAS
29456-76-6- PubChem CID
- 34588
Properties
Computed structural properties
- Topological polar surface area
- 36.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 390
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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