Basic information
- CAS
34580-74-0- Standard SMILES
OCCOc1nn(-c2cccc(C(F)(F)F)c2)c2ncccc12- InChIKey
IOLVNDULVQTBBV-UHFFFAOYSA-N- Molecular formula
- C15H12F3N3O2
- Average molar mass
- 323.27 g/mol
- Monoisotopic mass
- 323.08816112
Names & identifiers
- Preferred name
- Ethanol, 2-((1-(3-(trifluoromethyl)phenyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)oxy)-
- IUPAC
- 2-[1-[3-(trifluoromethyl)phenyl]pyrazolo[5,4-b]pyridin-3-yl]oxyethanol
- English name
- 2-[[1-(α,α,α-Trifluoro-m-tolyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]oxy]ethanol
- Molecular formula
- C15H12F3N3O2
- Molecular weight
- 323.2698896
Names & synonyms
ITF 102634580-74-0BRN 07035112-((1-(alpha,alpha,alpha-Trifluoro-m-tolyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)oxy)ethanolDTXSID70188142Ethanol, 2-((1-(3-(trifluoromethyl)phenyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)oxy)-Ethanol, 2-((1-(alpha,alpha,alpha-trifluoro-m-tolyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)oxy)-2-[[1-(alpha,alpha,alpha-Trifluoro-m-tolyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]oxy]ethanolRefChem:340754DTXCID00110633Ethanol, 2-((1-(3-(trifluoromethyl)phenyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)oxy)-(9CI)2-({1-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[3,4-b]pyridin-3-yl}oxy)ethan-1-ol
Show more names
ITF-10262-[[1-(α,α,α-Trifluoro-m-tolyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]oxy]ethanol
Ethanol, 2-((1-(3-(trifluoromethyl)phenyl)-1H-pyrazolo(3,4-b)pyridin-3-yl)oxy)- (9CI)
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 60.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 397
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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