2D Chemical StructureDatabase ID 949692
No renderable structure data available
SMILES
COC(=O)C1=CC=CC(=C1)CN2C=NC(=N2)[N+](=O)[O-]Structure data verified · Database ID 949692
Chemical Intermediate
methyl 3-[(3-nitro-1,2,4-triazol-1-yl)methyl]benzoate
CAS 406470-73-3Product ID 415641
| Intermediates | methyl 3-[(3-nitro-1,2,4-triazol-1-yl)methyl]benzoate |
|---|---|
| IUPAC Name | — |
| CAS Number | 406470-73-3 |
| Database ID | 949692 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
methyl 3-[(3-nitro-1,2,4-triazol-1-yl)methyl]benzoate
methyl 3-[(3-nitro-1,2,4-triazol-1-yl)methyl]benzoate (CAS 406470-73-3) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number406470-73-3
Database ID949692
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 949692
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- COC(=O)C1=CC=CC(=C1)CN2C=NC(=N2)[N+](=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 406470-73-3methyl 3-[(3-nitro-1,2,4-triazol-1-yl)methyl]benzoate
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