Basic information
- CAS
18706-24-6- Standard SMILES
Cc1cc(C)c2[nH]c(C(F)(F)F)cc(=O)c2c1- InChIKey
AGTURNBPTDBLLR-UHFFFAOYSA-N- Molecular formula
- C12H10F3NO
- Average molar mass
- 241.21 g/mol
- Monoisotopic mass
- 241.07144843
Names & identifiers
- Preferred name
- 6,8-Dimethyl-2-(trifluoromethyl)-4-quinolinol
- IUPAC
- 6,8-dimethyl-2-(trifluoromethyl)-1H-quinolin-4-one
Names & synonyms
6,8-Dimethyl-2-(trifluoromethyl)-4-quinolinolDTXSID60125419318706-24-66,8-Dimethyl-2-(trifluoromethyl)quinolin-4-ol
Database identifiers
- CAS
18706-24-6- PubChem CID
- 43668065
- DTXSID
DTXSID601254193
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 361
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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