Phenol, 2-(((1-(hydroxymethyl)propyl)amino)methyl)-6-methoxy-4-(2-propenyl)-
Basic information
- CAS
54219-85-1- Standard SMILES
C=CCc1cc(CNC(CC)CO)c(O)c(OC)c1- InChIKey
VQZVKMGNFWZVAW-UHFFFAOYSA-N- Molecular formula
- C15H23NO3
- Average molar mass
- 265.35 g/mol
- Monoisotopic mass
- 265.1677936
Names & identifiers
- Preferred name
- Phenol, 2-(((1-(hydroxymethyl)propyl)amino)methyl)-6-methoxy-4-(2-propenyl)-
- IUPAC
- 2-[(1-hydroxybutan-2-ylamino)methyl]-6-methoxy-4-prop-2-enylphenol
Names & synonyms
54219-85-1Phenol, 2-(((1-(hydroxymethyl)propyl)amino)methyl)-6-methoxy-4-(2-propenyl)-RefChem:10947952-(((1-(Hydroxymethyl)propyl)amino)methyl)-6-methoxy-4-(2-propenyl)phenolBRN 2747875NSC243882DTXSID701385058NSC 243882NSC-243882
Database identifiers
- CAS
54219-85-1- PubChem CID
- 99864
- DTXSID
DTXSID701385058
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 61.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 260
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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