2D Chemical StructureDatabase ID 5300018
No renderable structure data available
SMILES
CC(C)N1CC2=C(NC1)N3CC(SC3=NC2=O)(C)CStructure data verified · Database ID 5300018
Chemical Intermediate
4,4-dimethyl-11-propan-2-yl-5-thia-2,7,11,13-tetrazatricyclo[7.4.0.02,6]trideca-1(9),6-dien-8-one
CAS 889946-95-6Product ID 557834
| Intermediates | 4,4-dimethyl-11-propan-2-yl-5-thia-2,7,11,13-tetrazatricyclo[7.4.0.02,6]trideca-1(9),6-dien-8-one |
|---|---|
| IUPAC Name | — |
| CAS Number | 889946-95-6 |
| Database ID | 5300018 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
4,4-dimethyl-11-propan-2-yl-5-thia-2,7,11,13-tetrazatricyclo[7.4.0.02,6]trideca-1(9),6-dien-8-one
4,4-dimethyl-11-propan-2-yl-5-thia-2,7,11,13-tetrazatricyclo[7.4.0.02,6]trideca-1(9),6-dien-8-one (CAS 889946-95-6) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number889946-95-6
Database ID5300018
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 5300018
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CC(C)N1CC2=C(NC1)N3CC(SC3=NC2=O)(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 889946-95-64,4-dimethyl-11-propan-2-yl-5-thia-2,7,11,13-tetrazatricyclo[7.4.0.02,6]trideca-1(9),6-dien-8-one
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