2D Chemical StructureDatabase ID 39058245
No renderable structure data available
SMILES
C1=CC(=C(C=C1C(=O)O)Cl)N=C=SStructure data verified · Database ID 39058245
Chemical Intermediate
3-chloro-4-isothiocyanatobenzoic acid
CAS 1027512-44-2Product ID 17258
| Intermediates | 3-chloro-4-isothiocyanatobenzoic acid |
|---|---|
| IUPAC Name | — |
| CAS Number | 1027512-44-2 |
| Database ID | 39058245 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-chloro-4-isothiocyanatobenzoic acid
3-chloro-4-isothiocyanatobenzoic acid (CAS 1027512-44-2) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number1027512-44-2
Database ID39058245
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 39058245
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- C1=CC(=C(C=C1C(=O)O)Cl)N=C=S
- 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 1027512-44-23-chloro-4-isothiocyanatobenzoic acid
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