Benzenemethanol, alpha-((((2-hydroxy-3-methoxy-5-(2-propenyl)phenyl)methyl)amino)methyl)-
Basic information
- CAS
54219-86-2- Standard SMILES
C=CCc1cc(CNCC(O)c2ccccc2)c(O)c(OC)c1- InChIKey
YYBOTJPFGJAKDV-UHFFFAOYSA-N- Molecular formula
- C19H23NO3
- Average molar mass
- 313.4 g/mol
- Monoisotopic mass
- 313.1677936
Names & identifiers
- Preferred name
- Benzenemethanol, alpha-((((2-hydroxy-3-methoxy-5-(2-propenyl)phenyl)methyl)amino)methyl)-
- IUPAC
- 2-[[(2-hydroxy-2-phenylethyl)amino]methyl]-6-methoxy-4-prop-2-enylphenol
Names & synonyms
54219-86-2Benzenemethanol, alpha-((((2-hydroxy-3-methoxy-5-(2-propenyl)phenyl)methyl)amino)methyl)-RefChem:1078532alpha-((((2-Hydroxy-3-methoxy-5-(2-propenyl)phenyl)methyl)amino)methyl)benzenemethanolBRN 2765692NSC243883DTXSID401385059NSC 243883NSC-243883
Database identifiers
- CAS
54219-86-2- PubChem CID
- 99865
- DTXSID
DTXSID401385059
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 61.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 344
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Related reactions
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Compound notes
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