(4-Fluorobenzyl)(2-pyridinylmethyl)amine hydrochloride
Basic information
- CAS
774556-83-1- Standard SMILES
Cl.Fc1ccc(CNCc2ccccn2)cc1- InChIKey
BZXPWCUBPNLVGF-UHFFFAOYSA-N- Molecular formula
- C13H14ClFN2
- Average molar mass
- 252.71 g/mol
- Monoisotopic mass
- 252.0829543
Names & identifiers
- Preferred name
- (4-Fluorobenzyl)(2-pyridinylmethyl)amine hydrochloride
- IUPAC
- 1-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)methanamine;hydrochloride
- English name
- (4-Fluorobenzyl)(2-pyridinylmethyl)amine hydrochloride
- Molecular formula
- C13H13FN2
- Molecular weight
- 216.25
Names & synonyms
774556-83-1(4-FLUOROBENZYL)(2-PYRIDINYLMETHYL)AMINE HYDROCHLORIDEN-(4-Fluorobenzyl)-1-(pyridin-2-yl)methanamine hydrochloride1-(4-fluorophenyl)-N-(pyridin-2-ylmethyl)methanamine;hydrochloride1-(4-Fluorophenyl)-N-[(pyridin-2-yl)methyl]methanamine--hydrogen chloride (1/1)C13H14ClFN2DTXSID50388007AKOS022185117SR-01000288855SR-01000288855-1N-(4-Fluorobenzyl)-1-(pyridin-2-yl)methanaminehydrochloride[(4-fluorophenyl)methyl][(pyridin-2-yl)methyl]amine hydrochloride
Show more names
N-[(4-Fluorophenyl)methyl]-2-pyridinemethanamine2-Pyridinemethanamine, N-[(4-fluorophenyl)methyl]-(4-fluorobenzyl)(2-pyridinylmethyl)amine hydrochloride(SALTDATA: 2HCl)
Database identifiers
- CAS
774556-83-1- PubChem CID
- 2967950
- DTXSID
DTXSID50388007
Properties
Computed structural properties
- Topological polar surface area
- 24.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 190
Physicochemical properties
- Boiling point
- 317.7 · 317.7±27.0 °C(Predicted)
- Density
- 1.142 · 1.142±0.06 g/cm3(Predicted)
- pka
- 7.29 · 7.29±0.20(Predicted)
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Compound notes
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