Basic information
- CAS
35315-62-9- Standard SMILES
O=C(O)c1cc2ccccc2c2cc(C(F)(F)F)ccc12- InChIKey
BDVORRIWZACHKW-UHFFFAOYSA-N- Molecular formula
- C16H9F3O2
- Average molar mass
- 290.24 g/mol
- Monoisotopic mass
- 290.05546401
Names & identifiers
- Preferred name
- 6-(Trifluoromethyl)phenanthrene-9-carboxylic acid
- IUPAC
- 6-(trifluoromethyl)phenanthrene-9-carboxylic acid
Names & synonyms
6-(trifluoromethyl)phenanthrene-9-carboxylic acid35315-62-9DTXSID00300597RefChem:306986DTXCID002517326-Trifluoromethylphenathrene-9-carboxylic acidSCHEMBL10080476NSC137807NSC-137807DS-0156306-(Trifluoromethyl)-9-phenanthrenecarboxylic acid #
Database identifiers
- CAS
35315-62-9- PubChem CID
- 283306
- DTXSID
DTXSID00300597
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 407
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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