Basic information
- CAS
52723-08-7- Standard SMILES
COc1ccc2c(c1CN1CCCC1)C(=O)c1ccccc1C2=O- InChIKey
SZQDMWJAZPQSIV-UHFFFAOYSA-N- Molecular formula
- C20H19NO3
- Average molar mass
- 321.4 g/mol
- Monoisotopic mass
- 321.13649347
Names & identifiers
- Preferred name
- Anthraquinone, 2-methoxy-1-pyrrolidinylmethyl-
- IUPAC
- 2-methoxy-1-(pyrrolidin-1-ylmethyl)anthracene-9,10-dione
Names & synonyms
2-Methoxy-1-pyrrolidinylmethylanthraquinoneANTHRAQUINONE, 2-METHOXY-1-PYRROLIDINYLMETHYL-52723-08-7DTXSID50200694RefChem:319867DTXCID801231852-Methoxy-1-[(pyrrolidin-1-yl)methyl]anthracene-9,10-dione
Database identifiers
- CAS
52723-08-7- PubChem CID
- 40504
- DTXSID
DTXSID50200694
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 499
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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