Benzamidine, N-(m-fluorophenyl)-
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Basic information
- CAS
21719-87-9- Standard SMILES
NC(=Nc1cccc(F)c1)c1ccccc1- InChIKey
CKQSHOMBSPIFQT-UHFFFAOYSA-N- Molecular formula
- C13H11FN2
- Average molar mass
- 214.24 g/mol
- Monoisotopic mass
- 214.09062652
Names & identifiers
- Preferred name
- Benzamidine, N-(m-fluorophenyl)-
- IUPAC
- N'-(3-fluorophenyl)benzenecarboximidamide
- English name
- N-(m-Fluorophenyl)benzamidine
- Molecular formula
- C13H11FN2
- Molecular weight
- 214.24
Names & synonyms
Benzamidine, N-(m-fluorophenyl)-21719-87-9RefChem:1078144N-(3-Fluorophenyl)benzamidineN-(m-Fluorophenyl)benzamidineBRN 2368214N-(3-Fluorophenyl)benzenecarboximidamideBenzenecarboximidamide, N-(3-fluorophenyl)-SCHEMBL28144736DTXSID40944333AKOS012480683
Database identifiers
- CAS
21719-87-9- PubChem CID
- 210828
- DTXSID
DTXSID40944333- Nikkaji
- J73.162E
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 38.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 246
Physicochemical properties
- Melting point
- 99 °C · 99 °C
- Boiling point
- 297 · 297.0±42.0 °C(Predicted)
- Density
- 1.13 · 1.13±0.1 g/cm3(Predicted)
- pka
- 7.03 · 7.03±0.50(Predicted)
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Related reactions
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Compound notes
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