2D Chemical StructureDatabase ID 742551
No renderable structure data available
SMILES
CN1C=NC2=C1C(=O)N(C(=O)N2C)CC3=CC=CC=C3Structure data verified · Database ID 742551
Chemical Intermediate
1-Benzyltheobromine
CAS 55247-90-0Product ID 754107
| Intermediates | 1-Benzyltheobromine |
|---|---|
| IUPAC Name | — |
| CAS Number | 55247-90-0 |
| Database ID | 742551 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
1-Benzyltheobromine
1-Benzyltheobromine (CAS 55247-90-0) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number55247-90-0
Database ID742551
Molecular Formula—
Updated2026-10-16
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 742551
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CN1C=NC2=C1C(=O)N(C(=O)N2C)CC3=CC=CC=C3
- 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 55247-90-01-Benzyltheobromine
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