Basic information
- CAS
1993-98-2- Standard SMILES
O=C(O)c1cccc(F)c1C(=O)c1cccc2ccccc12- InChIKey
IYAAKRMQXYKIQX-UHFFFAOYSA-N- Molecular formula
- C18H11FO3
- Average molar mass
- 294.3 g/mol
- Monoisotopic mass
- 294.06922237
Names & identifiers
- Preferred name
- 3-Fluoro-2-(naphthalen-1-ylcarbonyl)benzoic acid
- IUPAC
- 3-fluoro-2-(naphthalene-1-carbonyl)benzoic acid
Names & synonyms
1993-98-23-fluoro-2-(naphthalen-1-ylcarbonyl)benzoic acid3-fluoro-2-(naphthalene-1-carbonyl)benzoic acidNSC97674NCIOpen2_006609DTXSID20294707NSC-97674
Database identifiers
- CAS
1993-98-2- PubChem CID
- 263290
- DTXSID
DTXSID20294707
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 436
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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