Products 1027513-02-5

CAS 1027513-02-5 is the registry number for 3-Carboxy-4-fluorophenylisothiocyanate, 95%. Offered by: Fluorochem. Available pack sizes: 1g.

3-Carboxy-4-fluorophenylisothiocyanate, 95%
Fluorochem
  • size: 1g
  • Variants: 1
from 1898.31
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Structural formula: {0} (CAS {1})

2-fluoro-5-isothiocyanatobenzoic acid (CAS 1027513-02-5) is a chemical compound with the molecular formula C8H4FNO2S and a molecular weight of 197.19 g/mol. IUPAC name: 2-fluoro-5-isothiocyanatobenzoic acid. InChIKey: CIJGKIHJSPOAFQ-UHFFFAOYSA-N.

Identity
Molecular formulaC8H4FNO2S
Molecular weight197.19 g/mol
IUPAC name2-fluoro-5-isothiocyanatobenzoic acid
InChIKeyCIJGKIHJSPOAFQ-UHFFFAOYSA-N
SMILESC1=CC(=C(C=C1N=C=S)C(=O)O)F

Computed by PubChem (NCBI)

Synonyms: 3-Carboxy-4-fluorophenylisothiocyanate, 2-fluoro-5-isothiocyanatobenzoic acid, 2-fluoro-5-isothiocyanato-benzoic acid
Isomers (same molecular formula)
5-fluoro-1,2-benzothiazole-3-carboxylic acid C8H4FNO2S
6-fluoro-1,3-benzothiazole-4-carboxylic acid C8H4FNO2S
5-fluoro-1,3-benzothiazole-2-carboxylic acid C8H4FNO2S
4-fluoro-1,3-benzothiazole-2-carboxylic acid C8H4FNO2S
4-fluorothieno[2,3-c]pyridine-2-carboxylic acid C8H4FNO2S
6-fluoro-1,3-benzothiazole-2-carboxylic acid C8H4FNO2S
3-fluoro-4-isothiocyanatobenzoic acid C8H4FNO2S

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