4-(4-bromophenyl)-2,3-dihydro-1H-benzo[f]cyclopenta[c]quinoline
Basic information
- CAS
24989-48-8- Standard SMILES
Brc1ccc(-c2nc3ccc4ccccc4c3c3c2CCC3)cc1- InChIKey
DLZGKKLYJWEZDL-UHFFFAOYSA-N- Molecular formula
- C22H16BrN
- Average molar mass
- 374.3 g/mol
Names & identifiers
- Preferred name
- 4-(4-bromophenyl)-2,3-dihydro-1H-benzo[f]cyclopenta[c]quinoline
- IUPAC
- 12-(4-bromophenyl)-11-azatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,8,11,13(17)-heptaene
- English name
- 4-(4-bromophenyl)-2,3-dihydro-1H-benzo[f]cyclopenta[c]quinoline
- Molecular formula
- C22H16BrN
- Molecular weight
- 374.27
Names & synonyms
4-(4-bromophenyl)-2,3-dihydro-1H-benzo[f]cyclopenta[c]quinoline24989-48-8STK699773AKOS00060519412-(4-bromophenyl)-11-azatetracyclo[8.7.0.02,7.013,17]heptadeca-1(10),2,4,6,8,11,13(17)-heptaeneST50230338AG-205/331350094-(4-bromophenyl)-1,2,3-trihydrobenzo[f]cyclopenta[1,2-c]quinoline1H-Benzo[f]cyclopenta[c]quinoline, 4-(4-bromophenyl)-2,3-dihydro-
Database identifiers
- CAS
24989-48-8
Properties
Computed structural properties
- XLogP
- 6.6
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 443
Physicochemical properties
- Melting point
- 185 · 185-186 °C
- Boiling point
- 559.6 · 559.6±50.0 °C(Predicted)
- Density
- 1.431 · 1.431±0.06 g/cm3(Predicted)
- pka
- 5.87 · 5.87±0.20(Predicted)
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Compound notes
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