2D Chemical StructureDatabase ID 10123265
No renderable structure data available
SMILES
C1CN(CCN(C(CN(CCN1CC(=O)O)CC(=O)O)CC2=CC=C(C=C2)N=C=S)CC(=O)O)CC(=O)OStructure data verified · Database ID 10123265
Chemical Intermediate
(p-SCN-Bn)-dota
CAS 127985-74-4Product ID 742123
| Intermediates | (p-SCN-Bn)-dota |
|---|---|
| IUPAC Name | — |
| CAS Number | 127985-74-4 |
| Database ID | 10123265 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
(p-SCN-Bn)-dota
(p-SCN-Bn)-dota (CAS 127985-74-4) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number127985-74-4
Database ID10123265
Molecular Formula—
Updated2026-10-16
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 10123265
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- C1CN(CCN(C(CN(CCN1CC(=O)O)CC(=O)O)CC2=CC=C(C=C2)N=C=S)CC(=O)O)CC(=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 127985-74-4(p-SCN-Bn)-dota
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