2D Chemical StructureDatabase ID 4604107
No renderable structure data available
SMILES
O(CC1C=CC=CC=1)C(C1=C(C)C(C(=O)OCC)=C(C)N1)=OStructure data verified · Database ID 4604107
Chemical Intermediate
1H-Pyrrole-2,4-dicarboxylic acid, 3,5-dimethyl-, 4-ethyl 2-(phenylmethyl) ester (9CI)
CAS 68999-91-7Product ID 744742
| Intermediates | 1H-Pyrrole-2,4-dicarboxylic acid, 3,5-dimethyl-, 4-ethyl 2-(phenylmethyl) ester (9CI) |
|---|---|
| IUPAC Name | — |
| CAS Number | 68999-91-7 |
| Database ID | 4604107 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
1H-Pyrrole-2,4-dicarboxylic acid, 3,5-dimethyl-, 4-ethyl 2-(phenylmethyl) ester (9CI)
1H-Pyrrole-2,4-dicarboxylic acid, 3,5-dimethyl-, 4-ethyl 2-(phenylmethyl) ester (9CI) (CAS 68999-91-7) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number68999-91-7
Database ID4604107
Molecular Formula—
Updated2026-10-16
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 4604107
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- O(CC1C=CC=CC=1)C(C1=C(C)C(C(=O)OCC)=C(C)N1)=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 68999-91-71H-Pyrrole-2,4-dicarboxylic acid, 3,5-dimethyl-, 4-ethyl 2-(phenylmethyl) ester (9CI)
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