2D Chemical StructureDatabase ID 9965968
No renderable structure data available
SMILES
O(C(C)(C)C)C(NC1=C(C=CC=C1C(=O)OC)[N+](=O)[O-])=OStructure data verified · Database ID 9965968
Chemical Intermediate
BENZOIC ACID, 2-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-3-NITRO-METHYL ESTER
CAS 57113-90-3Product ID 766690
| Intermediates | BENZOIC ACID, 2-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-3-NITRO-METHYL ESTER |
|---|---|
| IUPAC Name | — |
| CAS Number | 57113-90-3 |
| Database ID | 9965968 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
BENZOIC ACID, 2-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-3-NITRO-METHYL ESTER
BENZOIC ACID, 2-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-3-NITRO-METHYL ESTER (CAS 57113-90-3) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number57113-90-3
Database ID9965968
Molecular Formula—
Updated2025-04-09
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 9965968
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- O(C(C)(C)C)C(NC1=C(C=CC=C1C(=O)OC)[N+](=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 57113-90-3BENZOIC ACID, 2-[[(1,1-DIMETHYLETHOXY)CARBONYL]AMINO]-3-NITRO-METHYL ESTER
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