2D Chemical StructureDatabase ID 135658149
No renderable structure data available
SMILES
CCCCN1C(=O)NC(=N1)CNC2=CC=C(C=C2)ClStructure data verified · Database ID 135658149
Chemical Intermediate
2-butyl-5-[(4-chloroanilino)methyl]-4H-1,2,4-triazol-3-one
CAS 1232790-81-6Product ID 99148
| Intermediates | 2-butyl-5-[(4-chloroanilino)methyl]-4H-1,2,4-triazol-3-one |
|---|---|
| IUPAC Name | — |
| CAS Number | 1232790-81-6 |
| Database ID | 135658149 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
2-butyl-5-[(4-chloroanilino)methyl]-4H-1,2,4-triazol-3-one
2-butyl-5-[(4-chloroanilino)methyl]-4H-1,2,4-triazol-3-one (CAS 1232790-81-6) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number1232790-81-6
Database ID135658149
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 135658149
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CCCCN1C(=O)NC(=N1)CNC2=CC=C(C=C2)Cl
- 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 1232790-81-62-butyl-5-[(4-chloroanilino)methyl]-4H-1,2,4-triazol-3-one
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