2D Chemical StructureDatabase ID 640700
No renderable structure data available
SMILES
COC(=O)C1=CC(=C(C=C1)N)C#CStructure data verified · Database ID 640700
Chemical Intermediate
methyl 4-amino-3-ethynylbenzoate
CAS 412947-53-6Product ID 417510
| Intermediates | methyl 4-amino-3-ethynylbenzoate |
|---|---|
| IUPAC Name | — |
| CAS Number | 412947-53-6 |
| Database ID | 640700 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
methyl 4-amino-3-ethynylbenzoate
methyl 4-amino-3-ethynylbenzoate (CAS 412947-53-6) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number412947-53-6
Database ID640700
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 640700
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(=C(C=C1)N)C#C
- 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 412947-53-6methyl 4-amino-3-ethynylbenzoate
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