2D Chemical StructureDatabase ID 75046
No renderable structure data available
SMILES
C1=CC(=CC(=C1)N=C=S)C(=O)OStructure data verified · Database ID 75046
Chemical Intermediate
3-isothiocyanatobenzoic acid
CAS 2131-63-7Product ID 333616
| Intermediates | 3-isothiocyanatobenzoic acid |
|---|---|
| IUPAC Name | — |
| CAS Number | 2131-63-7 |
| Database ID | 75046 |
| Molecular Formula | — |
| Molecular Weight | — |
Product Information
3-isothiocyanatobenzoic acid
3-isothiocyanatobenzoic acid (CAS 2131-63-7) product identity, structure identifiers and related reaction data for chemical intermediate research and sourcing review.
CAS Number2131-63-7
Database ID75046
Molecular Formula—
Updated2023-01-08
Potential Applications
Potential Applications
For professional research and industrial use only
Database ID 75046
Computed Properties
Exact Mass—
XLogP—
Topological Polar Surface Area—
Hydrogen Bond Donors—
Hydrogen Bond Acceptors—
Rotatable Bonds—
- IUPAC Name
- —
- InChIKey
- —
- SMILES
- C1=CC(=CC(=C1)N=C=S)C(=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.
Request a Quote
Need this intermediate?
Send the required specification, quantity, destination and intended use. The CATO team will review availability and respond.
CAS 2131-63-73-isothiocyanatobenzoic acid
Complete inquiry