alpha-[(Dimethylamino)methyl]-2,5-dimethoxybenzenemethanol
Basic information
- CAS
3600-88-2- Standard SMILES
COc1ccc(OC)c(C(O)CN(C)C)c1- InChIKey
WIUPSOMVTZKAQS-UHFFFAOYSA-N- Molecular formula
- C12H19NO3
- Average molar mass
- 225.28 g/mol
- Monoisotopic mass
- 225.13649347
Names & identifiers
- Preferred name
- alpha-[(Dimethylamino)methyl]-2,5-dimethoxybenzenemethanol
- IUPAC
- 1-(2,5-dimethoxyphenyl)-2-(dimethylamino)ethanol
Names & synonyms
3600-88-2DTXSID8012114581-(2,5-Dimethoxyphenyl)-2-(dimethylamino)ethan-1-olalpha-[(Dimethylamino)methyl]-2,5-dimethoxybenzenemethanolI+/--[(Dimethylamino)methyl]-2,5-dimethoxybenzenemethanol
Database identifiers
- CAS
3600-88-2- PubChem CID
- 46242
- DTXSID
DTXSID801211458
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 199
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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