Products 1000577-91-2

CAS 1000577-91-2 appears in our catalog under these names: 2-Bromo-4-cyanophenylisothiocyanate, 95%, 3–Bromo–4–Isothiocyanato–Benzonitrile. Offered by: Fluorochem, GLPBio. Available pack sizes: 250mg, 1g, 5g.

2-Bromo-4-cyanophenylisothiocyanate, 95%
Fluorochem
  • size: 250mg, 1g, 5g
  • Variants: 3
from 299.91
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3–Bromo–4–Isothiocyanato–Benzonitrile
GLPBio
  • size: 1g
  • Variants: 1
from 1102.53
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Structural formula: {0} (CAS {1})

3-bromo-4-isothiocyanatobenzonitrile (CAS 1000577-91-2) is a chemical compound with the molecular formula C8H3BrN2S and a molecular weight of 239.09 g/mol. IUPAC name: 3-bromo-4-isothiocyanatobenzonitrile. InChIKey: TXSYSARBLBVCHQ-UHFFFAOYSA-N.

Identity
Molecular formulaC8H3BrN2S
Molecular weight239.09 g/mol
IUPAC name3-bromo-4-isothiocyanatobenzonitrile
InChIKeyTXSYSARBLBVCHQ-UHFFFAOYSA-N
SMILESC1=CC(=C(C=C1C#N)Br)N=C=S

Computed by PubChem (NCBI)

Synonyms: 3-Bromo-4-Isothiocyanato-Benzonitrile, 2-Bromo-4-cyanophenylisothiocyanate, 3-bromo-4-isothiocyanatobenzonitrile, Benzonitrile, 3-bromo-4-isothiocyanato-
Isomers (same molecular formula)
2-bromo-1,3-benzothiazole-5-carbonitrile C8H3BrN2S
6-bromo-1,3-benzothiazole-7-carbonitrile C8H3BrN2S
6-bromo-1,3-benzothiazole-2-carbonitrile C8H3BrN2S
2-bromo-1,3-benzothiazole-6-carbonitrile C8H3BrN2S

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