Tetraethyl 1,1,3,3-propanetetracarboxylate
Basic information
- CAS
2121-66-6- Standard SMILES
CCOC(=O)C(CC(C(=O)OCC)C(=O)OCC)C(=O)OCC- InChIKey
KSXISDYTRDNZLB-UHFFFAOYSA-N- Molecular formula
- C15H24O8
- Average molar mass
- 332.35 g/mol
- Monoisotopic mass
- 332.14711772
Names & identifiers
- Preferred name
- Tetraethyl 1,1,3,3-propanetetracarboxylate
- IUPAC
- tetraethyl propane-1,1,3,3-tetracarboxylate
- English name
- Methylenebismalonic acid diethyl ester
- Molecular formula
- C15H24O8
- Molecular weight
- 332.35
Names & synonyms
2121-66-6Tetraethyl 1,1,3,3-propanetetracarboxylateTETRAETHYL PROPANE-1,1,3,3-TETRACARBOXYLATENSC666533propane-1,1,3,3-tetracarboxylic acid tetraethyl esterNSC2322SCHEMBL4613459DTXSID80277430NSC-2322STL089746AKOS002312966NSC-666533
Show more names
Methylenebismalonic acid diethyl esterTetraethyl-1,1,3,3-propanetetra-carboxylate1,1,3,3-Tetraethyl propane-1,1,3,3-tetracarboxylate2-(3-Ethoxy-2-(ethoxycarbonyl)-3-oxopropyl)malonic acid2,2,4,4-Pentanetetracarboxylic acid, 1,2,4,5-tetraethyl ester
NCGC00322909-01ST50759420AB01318132-02diethyl 2,4-bis(ethoxycarbonyl)pentane-1,5-dioate1,3,3-PROPANETETRACARBOXYLIC ACID, TETRAETHYL ESTER
Database identifiers
- CAS
2121-66-6- PubChem CID
- 220073
- DTXSID
DTXSID80277430- Nikkaji
- J449.995F
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 14
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 344
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Physicochemical properties
- Melting point
- -30 °C · -30°C
- Boiling point
- 389.48 °C · 389.48°C (rough estimate)
- Density
- 1.116 · 1.1160
- refractive index
- 1.4398 · 1.4398 (estimate)
- pka
- 11.85 · 11.85±0.59(Predicted)
Chemistry & industry
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