2-Imidazoline, 2-(alpha-propoxybenzyl)-
Basic information
- CAS
33236-21-4- Standard SMILES
CCCOC(C1=NCCN1)c1ccccc1- InChIKey
QNGDOQFAQQYFNF-UHFFFAOYSA-N- Molecular formula
- C13H18N2O
- Average molar mass
- 218.29 g/mol
- Monoisotopic mass
- 218.1419132
Names & identifiers
- Preferred name
- 2-Imidazoline, 2-(alpha-propoxybenzyl)-
- IUPAC
- 2-[phenyl(propoxy)methyl]-4,5-dihydro-1H-imidazole
- English name
- 2-(α-Propoxybenzyl)-2-imidazoline
- Molecular formula
- C13H18N2O
- Molecular weight
- 218.29482
Names & synonyms
2-(alpha-Propoxybenzyl)-2-imidazoline-33236-21-42-IMIDAZOLINE, 2-(alpha-PROPOXYBENZYL)-RefChem:2620152-[phenyl(propoxy)methyl]-4,5-dihydro-1H-imidazole2-(alpha-Propoxybenzyl)-2-imidazolineDTXSID609548732-(α-Propoxybenzyl)-2-imidazoline1H-Imidazole, 4,5-dihydro-2-(phenylpropoxymethyl)-
Database identifiers
- CAS
33236-21-4- PubChem CID
- 36386
- DTXSID
DTXSID60954873- Nikkaji
- J61.619B
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 33.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 234
Physicochemical properties
- Boiling point
- 365.1 · 365.1±35.0 °C(Predicted)
- Density
- 1.09 · 1.09±0.1 g/cm3(Predicted)
- pka
- 9.78 · 9.78±0.40(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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