2D Chemical StructureDatabase ID 59398677
No renderable structure data available
SMILES
O(C)C(C1C=C(C#C)C(C(=O)OC)=CC=1C#C)=OStructure data verified · Database ID 59398677
Chemical Intermediate
1,4-benzenedicarboxylic acid, 2,5-diethynyl-, 1,4-dimethyl ester
CAS 944458-59-7Product ID 727226
| Intermediates | 1,4-benzenedicarboxylic acid, 2,5-diethynyl-, 1,4-dimethyl ester |
|---|---|
| IUPAC Name | — |
| CAS Number | 944458-59-7 |
| Database ID | 59398677 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
1,4-benzenedicarboxylic acid, 2,5-diethynyl-, 1,4-dimethyl ester
1,4-benzenedicarboxylic acid, 2,5-diethynyl-, 1,4-dimethyl ester (CAS 944458-59-7) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number944458-59-7
Database ID59398677
Molecular Formula—
Updated2026-10-16
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 59398677
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- O(C)C(C1C=C(C#C)C(C(=O)OC)=CC=1C#C)=O
- InChI
- —
Safety Notice
Safety & Notes
For professional research and industrial use only. Review the supplier safety data sheet before handling.
PubChem References
Public References
These sources are listed in the compound's public database record.
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CAS 944458-59-71,4-benzenedicarboxylic acid, 2,5-diethynyl-, 1,4-dimethyl ester
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