Basic information
- CAS
25435-35-2- Standard SMILES
CC(Cc1ccco1)CN(C)C- InChIKey
NUSITTGPPMRNSQ-UHFFFAOYSA-N- Molecular formula
- C10H17NO
- Average molar mass
- 167.25 g/mol
- Monoisotopic mass
- 167.13101417
Names & identifiers
- Preferred name
- 3-(Furan-2-yl)-N,N,2-trimethylpropan-1-amine
- IUPAC
- 3-(furan-2-yl)-N,N,2-trimethylpropan-1-amine
- English name
- N,N,β-Trimethyl-2-furan-1-propanamine
- Molecular formula
- C10H17NO
- Molecular weight
- 167.25
Names & synonyms
3-(furan-2-yl)-N,N,2-trimethylpropan-1-amine25435-35-2DTXSID50948302RefChem:1067148DTXCID701376536N,N,beta-Trimethyl-2-furanpropylamineBRN 14238582-FURANPROPYLAMINE, N,N,beta-TRIMETHYL-
Database identifiers
- CAS
25435-35-2- PubChem CID
- 32985
- DTXSID
DTXSID50948302- Nikkaji
- J75.517F
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 16.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 125
Physicochemical properties
- Boiling point
- 209.8 · 209.8±23.0 °C(Predicted)
- Density
- 0.935 · 0.935±0.06 g/cm3(Predicted)
- pka
- 9.47 · 9.47±0.28(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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