Basic information
- CAS
52723-06-5- Standard SMILES
COc1ccc2c(c1CN(C)C)C(=O)c1ccccc1C2=O- InChIKey
NSTONUBYIUEEBA-UHFFFAOYSA-N- Molecular formula
- C18H17NO3
- Average molar mass
- 295.3 g/mol
- Monoisotopic mass
- 295.1208434
Names & identifiers
- Preferred name
- Anthraquinone, 1-(dimethylamino)methyl-2-methoxy-
- IUPAC
- 1-[(dimethylamino)methyl]-2-methoxyanthracene-9,10-dione
Names & synonyms
BRN 2148463ANTHRAQUINONE, 1-(DIMETHYLAMINO)METHYL-2-METHOXY-1-(Dimethylamino)methyl-2-methoxyanthraquinone52723-06-5DTXSID30200692RefChem:319861DTXCID601231831-[(dimethylamino)methyl]-2-methoxyanthracene-9,10-dione
Database identifiers
- CAS
52723-06-5- PubChem CID
- 40502
- DTXSID
DTXSID30200692
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 448
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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