3-(Dipropylamino)propyl 4-fluorobenzoate
Basic information
- CAS
399-14-4- Standard SMILES
CCCN(CCC)CCCOC(=O)c1ccc(F)cc1- InChIKey
BJKDVQYYOPQRGF-UHFFFAOYSA-N- Molecular formula
- C16H24FNO2
- Average molar mass
- 281.37 g/mol
- Monoisotopic mass
- 281.17910717
Names & identifiers
- Preferred name
- 3-(Dipropylamino)propyl 4-fluorobenzoate
- IUPAC
- 3-(dipropylamino)propyl 4-fluorobenzoate
Names & synonyms
3-(dipropylamino)propyl 4-fluorobenzoate399-14-4DTXSID901024258
Database identifiers
- CAS
399-14-4- PubChem CID
- 9950
- DTXSID
DTXSID901024258
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 259
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Compound notes
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