Basic information
- CAS
309265-55-2- Standard SMILES
CCc1ccc(C2(C)CC(C)(C)N(C(=O)c3ccc(F)cc3)c3ccccc32)cc1- InChIKey
ITBRMXBMLQJRML-UHFFFAOYSA-N- Molecular formula
- C27H28FNO
- Average molar mass
- 401.5 g/mol
- Monoisotopic mass
- 401.21549268
Names & identifiers
- Preferred name
- 4-(4-Ethylphenyl)-1-(4-fluorobenzoyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinoline
- IUPAC
- [4-(4-ethylphenyl)-2,2,4-trimethyl-3H-quinolin-1-yl]-(4-fluorophenyl)methanone
- English name
- 4-(4-ethylphenyl)-1-(4-fluorobenzoyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinoline
- Molecular formula
- C27H28FNO
- Molecular weight
- 401.52
Names & synonyms
4-(4-ethylphenyl)-1-(4-fluorobenzoyl)-2,2,4-trimethyl-1,2,3,4-tetrahydroquinoline309265-55-2(4-(4-ethylphenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl)(4-fluorophenyl)methanone[4-(4-ethylphenyl)-2,2,4-trimethyl-3,4-dihydroquinolin-1(2H)-yl](4-fluorophenyl)methanone[4-(4-ethylphenyl)-2,2,4-trimethyl-3H-quinolin-1-yl]-(4-fluorophenyl)methanoneOprea1_220575Oprea1_238691STK789385AKOS000617646AKOS022016608AG-690/12002147SR-01000525151
Show more names
Methanone, [4-(4-ethylphenyl)-3,4-dihydro-2,2,4-trimethyl-1(2H)-quinolinyl](4-fluorophenyl)-
SR-01000525151-1
Database identifiers
- CAS
309265-55-2
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 602
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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