Basic information
- CAS
326-39-6- Standard SMILES
CCCN(CCC)CCOC(=O)c1ccc(F)cc1.Cl- InChIKey
YKKJMROIHDNINT-UHFFFAOYSA-N- Molecular formula
- C15H23ClFNO2
- Average molar mass
- 303.8 g/mol
- Monoisotopic mass
- 303.1401348
Names & identifiers
- Preferred name
- Benzoic acid, p-fluoro-, dipropylaminoethyl ester, hydrochloride
- IUPAC
- 2-(dipropylamino)ethyl 4-fluorobenzoate;hydrochloride
Names & synonyms
Dipropylaminoethyl p-fluorobenzoate hydrochloride326-39-6BENZOIC ACID, p-FLUORO-, DIPROPYLAMINOETHYL ESTER, HYDROCHLORIDEp-Fluorobenzoic acid dipropylaminoethyl ester hydrochlorideDTXSID80186290RefChem:327943DTXCID901087812-(Dipropylamino)ethyl 4-fluorobenzoate--hydrogen chloride (1/1)
Database identifiers
- CAS
326-39-6- PubChem CID
- 9467
- DTXSID
DTXSID80186290
Properties
Computed structural properties
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 247
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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