2-Propanol, 1-(diethylamino)-3-[2-(2-propenyl)phenoxy]-
Basic information
- CAS
57123-41-8- Standard SMILES
C=CCc1ccccc1OCC(O)CN(CC)CC- InChIKey
JMCHRWNOYSRJQT-UHFFFAOYSA-N- Molecular formula
- C16H25NO2
- Average molar mass
- 263.37 g/mol
- Monoisotopic mass
- 263.18852904
Names & identifiers
- Preferred name
- 2-Propanol, 1-(diethylamino)-3-[2-(2-propenyl)phenoxy]-
- IUPAC
- 1-(diethylamino)-3-(2-prop-2-enylphenoxy)propan-2-ol
Names & synonyms
ChemDiv2_000933HMS1371K0957123-41-82-Propanol, 1-(diethylamino)-3-[2-(2-propenyl)phenoxy]-Oprea1_190717CHEMBL1623792DTXSID704050031-(DIETHYLAMINO)-3-[2-(PROP-2-EN-1-YL)PHENOXY]PROPAN-2-OL
Database identifiers
- CAS
57123-41-8- PubChem CID
- 4623799
- DTXSID
DTXSID70405003- ChEMBL
CHEMBL1623792
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 241
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Related reactions
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Compound notes
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