2D Chemical StructureDatabase ID 839868
No renderable structure data available
SMILES
CC1=C(C(=NN1CC2=CC(=CC=C2)C(=O)O)C)[N+](=O)[O-]Structure data verified · Database ID 839868
Chemical Intermediate
3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzoic acid
CAS 400752-48-9Product ID 413259
| Intermediates | 3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzoic acid |
|---|---|
| IUPAC Name | — |
| CAS Number | 400752-48-9 |
| Database ID | 839868 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzoic acid
3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzoic acid (CAS 400752-48-9) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number400752-48-9
Database ID839868
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 839868
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC1=C(C(=NN1CC2=CC(=CC=C2)C(=O)O)C)[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 400752-48-93-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzoic acid
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