N-(furan-2-ylmethyl)propan-1-amine
Basic information
- CAS
39191-12-3- Standard SMILES
CCCNCc1ccco1- InChIKey
LPPWAQZJYMWSHG-UHFFFAOYSA-N- Molecular formula
- C8H13NO
- Average molar mass
- 139.19 g/mol
- Monoisotopic mass
- 139.09971404
Names & identifiers
- Preferred name
- N-(furan-2-ylmethyl)propan-1-amine
- IUPAC
- N-(furan-2-ylmethyl)propan-1-amine
- English name
- N-(2-furylmethyl)-N-propylamine
- Molecular formula
- C8H13NO
- Molecular weight
- 139.19
Names & synonyms
39191-12-3N-(furan-2-ylmethyl)propan-1-amine(2-FURYLMETHYL)PROPYLAMINE[(furan-2-yl)methyl](propyl)amineMFCD07410480N-(2-furylmethyl)-N-propylamineN-(2-furylmethyl)propan-1-amineSCHEMBL4992171SCHEMBL7468419DTXSID20275612AKOS000142000SB60993
Show more names
AKOS ISYA01098UKRORGSYN-BB BBV-0230362-Furanmethanamine, N-propyl-(2-furylmethyl)propylamine(SALTDATA: FREE)
N-[(Furan-2-yl)methyl]propan-1-amineBS-37843DB-179110F315990
Database identifiers
- CAS
39191-12-3- PubChem CID
- 55759
- DTXSID
DTXSID20275612- Nikkaji
- J893.322G
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 25.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 85.3
Physicochemical properties
- Melting point
- 184 · 184-185 °C
- Boiling point
- 179.2 · 179.2±15.0 °C(Predicted)
- Density
- 0.947 · 0.947±0.06 g/cm3(Predicted)
- pka
- 8.98 · 8.98±0.19(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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