3-(5H-Dibenzo(b,f)azepin-5-yl)-N,N-dimethylpropan-1-amine--hydrogen chloride (1/1)
Basic information
- CAS
58262-51-4- Standard SMILES
CN(C)CCCN1c2ccccc2C=Cc2ccccc21.Cl- InChIKey
QHOQDRVNCMCLDK-UHFFFAOYSA-N- Molecular formula
- C19H23ClN2
- Average molar mass
- 314.9 g/mol
- Monoisotopic mass
- 314.1549764
Overview
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Names & identifiers
- Preferred name
- 3-(5H-Dibenzo(b,f)azepin-5-yl)-N,N-dimethylpropan-1-amine--hydrogen chloride (1/1)
- IUPAC
- 3-benzo[b][1]benzazepin-11-yl-N,N-dimethylpropan-1-amine;hydrochloride
- English name
- BalipraMine Hydrochloride (IMpurity)
- Molecular formula
- C19H22N2
- Molecular weight
- 278.39138
Names & synonyms
DTXSID409738253-(5H-Dibenzo(b,f)azepin-5-yl)-N,N-dimethylpropan-1-amine--hydrogen chloride (1/1)3-(5H-Dibenzo[b,f]azepin-5-yl)-N,N-dimethylpropan-1-amine--hydrogen chloride (1/1)RefChem:1066940DTXCID50140126858262-51-4Balipramine Hydrochloride (Impurity)N,N-Dimethyl-5H-dibenz(b,f)azepine-5-propanamine monohydrochlorideImipramine Hydrochloride Impurity B3-benzo[b][1]benzazepin-11-yl-N,N-dimethylpropan-1-amine;hydrochloride(3-{2-azatricyclo[9.4.0.0,3,8]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-2-yl}propyl)dimethylamine hydrochlorideG 31406 hydrochloride
Show more names
G-31406 HClDepramine ImpurityImipramine EP Impurity BBalipramine HydrochlorideImipramine Impurity 2（Imipramine EP Impurity B）3-(5H-Dibenzo[b,f]azepin-5-yl)-N,N-dimethylpropan-1-amine (depramine) HydrochlorideImipramine hydrochloride Imp.B (EP) as Hydrochloride: 3-(5H-dibenzo[b,f]azepin-5-yl)-N,N-dimethylpropan-1-amine (depramine)
Properties
Computed structural properties
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 323
Physicochemical properties
- Melting point
- 176 · 176-177 °C
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- color
- Yellow to Very Dark Yellow
- Major Application
- pharmaceutical (small molecule)
- InChI
- 1S/C19H22N2.ClH/c1-20(2)14-7-15-21-18-10-5-3-8-16(18)12-13-17-9-4-6-11-19(17)21;/h3-6,8-13H,7,14-15H2,1-2H3;1H
- InChIKey
- QHOQDRVNCMCLDK-UHFFFAOYSA-N
- SMILES
- Cl.[n]1(c2c(ccc3c1cccc3)cccc2)CCCN(C)C
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 24 · NA.24
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 301 · P301+P312+P330
- WGK Germany
- 3 · WGK 3
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
- wgk
- WGK 3
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302
- Hazard Classifications
- Acute Tox. 4 Oral
- Precautionary statements
- P301+P312+P330
Chemistry & industry
Applications
UsesBalipramine Hydrochloride is a tricyclic anti-depressant compound. This is the salt form of Balipramine (Depramine), which has shown clinical antidepressant activity. Also known as imipramine impurity B.
Related reactions
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Compound notes
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