CAS 2131-63-7 appears in our catalog under these names: 3-Carboxyphenyl isothiocyanate, 95%, 3-Carboxyphenylisothiocyanate, 97%, 3-Carboxyphenyl isothiocyanate, 97% , 3-Carboxyphenyl isothiocyanate. Offered by: Combi-blocks, Chemat Brand, Thermo Scientific (Alfa Aesar), Fluorochem. Available pack sizes: 250mg, 1g, on request, 5g, 25g.
3-isothiocyanatobenzoic acid (CAS 2131-63-7) is a chemical compound with the molecular formula C8H5NO2S and a molecular weight of 179.20 g/mol. IUPAC name: 3-isothiocyanatobenzoic acid. InChIKey: PJRBPKOOGLKPFB-UHFFFAOYSA-N.
| Molecular formula | C8H5NO2S |
|---|---|
| Molecular weight | 179.20 g/mol |
| IUPAC name | 3-isothiocyanatobenzoic acid |
| InChIKey | PJRBPKOOGLKPFB-UHFFFAOYSA-N |
| SMILES | C1=CC(=CC(=C1)N=C=S)C(=O)O |
Computed by PubChem (NCBI)