Basic information
- Standard SMILES
C#CCn1c(C(F)(F)F)c(C(O)C#C)c2ccccc21- InChIKey
TZKXOVMWWOXNBQ-UHFFFAOYSA-N- Molecular formula
- C15H10F3NO
- Average molar mass
- 277.24 g/mol
Names & identifiers
- Preferred name
- 1(RS) [1-(2-propynyl)-2-trifluoromethyl-(1H)-indol-3-yl]-prop-2-ynyl alcohol
- IUPAC
- 1-[1-prop-2-ynyl-2-(trifluoromethyl)indol-3-yl]prop-2-yn-1-ol
Names & synonyms
SCHEMBL10493573TZKXOVMWWOXNBQ-UHFFFAOYSA-N1(RS) [1-(2-propynyl)-2-trifluoromethyl-(1H)-indol-3-yl]-prop-2-ynyl alcohol
Database identifiers
- PubChem CID
- 88619783
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 25.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 455
Related reactions
1 records
Compound notes
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