5H-Dibenz(b,f)azepine, 5-methyl-
Basic information
- CAS
52249-32-8- Standard SMILES
CN1c2ccccc2C=Cc2ccccc21- InChIKey
WKMPLZAFPNQAMR-UHFFFAOYSA-N- Molecular formula
- C15H13N
- Average molar mass
- 207.27 g/mol
- Monoisotopic mass
- 207.10479942
Names & identifiers
- Preferred name
- 5H-Dibenz(b,f)azepine, 5-methyl-
- IUPAC
- 11-methylbenzo[b][1]benzazepine
- English name
- 5-Methyl-5H-dibenz[b,f]azepine
- Molecular formula
- C15H13N
- Molecular weight
- 207.27
Names & synonyms
52249-32-85H-Dibenz(b,f)azepine, 5-methyl-5-Methyl-5H-dibenz(b,f)azepine5-Methyl-5H-dibenz[b,f]azepineDTXSID80200288RefChem:305445DTXCID8012277911-methylbenzo[b][1]benzazepineN-Methyl Iminostilbene5-methyl-5H-dibenzo[b,f]azepineN-Methyliminostilbene (N-Methyl-2,2'-iminostilbene)SCHEMBL2607158
Show more names
-iminostilbeneN-Methyl-2,2’N-Methyl IminostilbeneN-methyldibenzazepineN-Methyl-2,2'-iminostilbene5H-Dibenz[b,f]azepine, 5-methyl-
11-methyl-11H-benzo[b][1]benzazepineDB-3068175-Methyl-5H-dibenz[b,f]azepine; 5-Methyldibenz[b,f]azepine; N-Methyl-2,2'-iminostilbene; RP 26443
Database identifiers
- CAS
52249-32-8- PubChem CID
- 148571
- DTXSID
DTXSID80200288- Nikkaji
- J89.688H
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 245
Physicochemical properties
- Melting point
- 106 · 106-108 °C
- Boiling point
- 341.693 · 341.693±22.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.102 · 1.102±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- solubility
- DCM, Toluene
- form
- Solid
- pka
- 1.438 · 1.438±0.20(predicted)
- color
- Yellow
Chemistry & industry
Applications
UsesN-Methyl-2,2''-iminostilbene is an metabolites of Metapramine (M225830), found in plasma in depressed inpatients.
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Related reactions
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Compound notes
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