2D Chemical StructureDatabase ID 71668833
No renderable structure data available
SMILES
COC1=NN(C=C1[N+](=O)[O-])CC2=NN=C3N2CCCCC3Structure data verified · Database ID 71668833
Chemical Intermediate
3-[(3-methoxy-4-nitropyrazol-1-yl)methyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
CAS 1245772-20-6Product ID 105048
| Intermediates | 3-[(3-methoxy-4-nitropyrazol-1-yl)methyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine |
|---|---|
| IUPAC Name | — |
| CAS Number | 1245772-20-6 |
| Database ID | 71668833 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-[(3-methoxy-4-nitropyrazol-1-yl)methyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
3-[(3-methoxy-4-nitropyrazol-1-yl)methyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine (CAS 1245772-20-6) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number1245772-20-6
Database ID71668833
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 71668833
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- COC1=NN(C=C1[N+](=O)[O-])CC2=NN=C3N2CCCCC3
- 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 1245772-20-63-[(3-methoxy-4-nitropyrazol-1-yl)methyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
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