2-(3,4-Dimethoxyphenyl)-4,5-dimethoxyindene-1,3-dione
Basic information
- CAS
1641-12-9- Standard SMILES
COc1ccc(C2C(=O)c3ccc(OC)c(OC)c3C2=O)cc1OC- InChIKey
FCOLNSHCPVSQEI-UHFFFAOYSA-N- Molecular formula
- C19H18O6
- Average molar mass
- 342.3 g/mol
- Monoisotopic mass
- 342.11033829
Names & identifiers
- Preferred name
- 2-(3,4-Dimethoxyphenyl)-4,5-dimethoxyindene-1,3-dione
- IUPAC
- 2-(3,4-dimethoxyphenyl)-4,5-dimethoxyindene-1,3-dione
Names & synonyms
1641-12-9NSC 215217NSC2152172-(3,4-dimethoxyphenyl)-4,5-dimethoxyindene-1,3-dioneDTXSID50309732NSC-2152172-(3,4-Dimethoxyphenyl)-4,5-dimethoxy-1H-indene-1,3(2H)-dione
Database identifiers
- CAS
1641-12-9- PubChem CID
- 310607
- DTXSID
DTXSID50309732
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 506
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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