Tetraethyl propadiene-1,1,3,3-tetracarboxylate
Basic information
- CAS
67761-23-3- Standard SMILES
CCOC(=O)C(=C=C(C(=O)OCC)C(=O)OCC)C(=O)OCC- InChIKey
TWIJAMVVGFTEBP-UHFFFAOYSA-N- Molecular formula
- C15H20O8
- Average molar mass
- 328.31 g/mol
- Monoisotopic mass
- 328.11581759
Names & identifiers
- Preferred name
- Tetraethyl propadiene-1,1,3,3-tetracarboxylate
- IUPAC
- tetraethyl propa-1,2-diene-1,1,3,3-tetracarboxylate
Names & synonyms
67761-23-3NSC179430Tetraethyl propadiene-1,1,3,3-tetracarboxylateDTXSID103067221,1,3,3-tetra(ethoxylcarbonyl)alleneNSC-179430tetraethyl allene-1,1,3,3-tetracarboxylate1,2-propadiene-1,1,3,3-tetracarboxylic acid, tetraethyl ester1,2-PROPADIENE,1,1,3,3-TETRACARBOXYLIC ACID,TETRAETHYL ESTERInChI=1/C15H20O8/c1-5-20-12(16)10(13(17)21-6-2)9-11(14(18)22-7-3)15(19)23-8-4/h5-8H2,1-4H
Database identifiers
- CAS
67761-23-3- PubChem CID
- 301562
- DTXSID
DTXSID10306722- Nikkaji
- J3.087.277K
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 12
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 436
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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