2D Chemical StructureDatabase ID 3748282
No renderable structure data available
SMILES
CC(C)(C)C(=O)C(CC1=CC=CC=C1Cl)N2C=NC=N2Structure data verified · Database ID 3748282
Chemical Intermediate
1-(2-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-one
CAS 68041-57-6Product ID 489842
| Intermediates | 1-(2-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-one |
|---|---|
| IUPAC Name | — |
| CAS Number | 68041-57-6 |
| Database ID | 3748282 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
1-(2-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-one
1-(2-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-one (CAS 68041-57-6) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number68041-57-6
Database ID3748282
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 3748282
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC(C)(C)C(=O)C(CC1=CC=CC=C1Cl)N2C=NC=N2
- 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 68041-57-61-(2-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-one
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