2D Chemical StructureDatabase ID 5090
No renderable structure data available
SMILES
S(C)(C1C=CC(=CC=1)C1COC(C=1C1C=CC=CC=1)=O)(=O)=OStructure data verified · Database ID 5090
Chemical Intermediate
Rofecoxib
CAS 162011-90-7Product ID 772410
| Intermediates | Rofecoxib |
|---|---|
| IUPAC Name | — |
| CAS Number | 162011-90-7 |
| Database ID | 5090 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
Rofecoxib
Rofecoxib (CAS 162011-90-7) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number162011-90-7
Database ID5090
Molecular Formula—
Updated2025-04-09
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 5090
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- S(C)(C1C=CC(=CC=1)C1COC(C=1C1C=CC=CC=1)=O)(=O)=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 162011-90-7Rofecoxib
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