2D Chemical StructureDatabase ID 3145114
No renderable structure data available
SMILES
CCC1=NC(=C(C2=C1CCCC2)C#N)SCC(=O)OStructure data verified · Database ID 3145114
Chemical Intermediate
2-[(4-cyano-1-ethyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]acetic acid
CAS 95546-61-5Product ID 596981
| Intermediates | 2-[(4-cyano-1-ethyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]acetic acid |
|---|---|
| IUPAC Name | — |
| CAS Number | 95546-61-5 |
| Database ID | 3145114 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
2-[(4-cyano-1-ethyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]acetic acid
2-[(4-cyano-1-ethyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]acetic acid (CAS 95546-61-5) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number95546-61-5
Database ID3145114
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 3145114
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- CCC1=NC(=C(C2=C1CCCC2)C#N)SCC(=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 95546-61-52-[(4-cyano-1-ethyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]acetic acid
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