Basic information
- CAS
67801-54-1- Standard SMILES
COC(=O)c1ccc2c(c1)C(=O)c1ccc(C(=O)OC)cc1-2- InChIKey
QOPVBVXFXFHNSO-UHFFFAOYSA-N- Molecular formula
- C17H12O5
- Average molar mass
- 296.27 g/mol
- Monoisotopic mass
- 296.06847348
Names & identifiers
- Preferred name
- 9H-Fluorene-2,6-dicarboxylic acid, 9-oxo-, 2,6-dimethyl ester
- IUPAC
- dimethyl 9-oxofluorene-2,6-dicarboxylate
- English name
- dimethyl 9-oxo-9H-fluorene-2,6-dicarboxylate
- Molecular formula
- C17H12O5
- Molecular weight
- 296.27
Names & synonyms
EINECS 267-173-49H-Fluorene-2,6-dicarboxylic acid, 9-oxo-, 2,6-dimethyl esterRefChem:549959Dimethyl 9-oxo-9H-fluorene-2,6-dicarboxylate67801-54-19H-Fluorene-2,6-dicarboxylic acid, 9-oxo-, dimethyl esterdimethyl9-oxo-9H-fluorene-2,6-dicarboxylateDTXSID8070623SCHEMBL25260739SCHEMBL31065274QOPVBVXFXFHNSO-UHFFFAOYSA-NNS00036184
Show more names
9-Oxo-9H-fluorene-2,6-dicarboxylic acid dimethyl ester
Database identifiers
- CAS
67801-54-1- PubChem CID
- 105656
- DTXSID
DTXSID8070623- EC Number
- 267-173-4
- Nikkaji
- J20.891D
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 69.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 485
Physicochemical properties
- EPA Substance Registry System
- 9 H-Fluorene-2,6-dicarboxylic · 9H-Fluorene-2,6-dicarboxylic acid, 9-oxo-, dimethyl ester (67801-54-1)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information9H-Fluorene-2,6-dicarboxylic acid, 9-oxo-, 2,6-dimethyl ester: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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