Xanthen-9-one, 4-((dimethylamino)methyl)-3-methoxy-, hydrochloride
Basic information
- CAS
17854-74-9- Standard SMILES
COc1ccc2c(=O)c3ccccc3oc2c1CN(C)C.Cl- InChIKey
AGZFXVPTKPONNP-UHFFFAOYSA-N- Molecular formula
- C17H18ClNO3
- Average molar mass
- 319.8 g/mol
- Monoisotopic mass
- 319.0975211
Names & identifiers
- Preferred name
- Xanthen-9-one, 4-((dimethylamino)methyl)-3-methoxy-, hydrochloride
- IUPAC
- 4-[(dimethylamino)methyl]-3-methoxyxanthen-9-one;hydrochloride
Names & synonyms
Xanthen-9-one, 4-((dimethylamino)methyl)-3-methoxy-, hydrochloride17854-74-94-((Dimethylamino)methyl)-3-methoxyxanthen-9-one hydrochlorideDTXSID10170506RefChem:388432DTXCID10929974-[(Dimethylamino)methyl]-3-methoxy-9H-xanthen-9-one--hydrogen chloride (1/1)
Database identifiers
- CAS
17854-74-9- PubChem CID
- 205369
- DTXSID
DTXSID10170506
Properties
Computed structural properties
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 384
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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