Products 680214-97-5

CAS 680214-97-5 is the registry number for 4-tert-Butylbenzoyl isothiocyanate, 95%. Offered by: Combi-blocks. Available pack sizes: 1g, 100mg, 5g, 250mg.

4-tert-Butylbenzoyl isothiocyanate, 95%
Combi-blocks
  • size: 1g, 100mg, 5g, 250mg
  • Variants: 4
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Structural formula: {0} (CAS {1})

4-tert-butylbenzoyl isothiocyanate (CAS 680214-97-5) is a chemical compound with the molecular formula C12H13NOS and a molecular weight of 219.30 g/mol. IUPAC name: 4-tert-butylbenzoyl isothiocyanate. InChIKey: ISBLKWMZWUQAJN-UHFFFAOYSA-N.

Identity
Molecular formulaC12H13NOS
Molecular weight219.30 g/mol
IUPAC name4-tert-butylbenzoyl isothiocyanate
InChIKeyISBLKWMZWUQAJN-UHFFFAOYSA-N
SMILESCC(C)(C)C1=CC=C(C=C1)C(=O)N=C=S

Computed by PubChem (NCBI)

Synonyms: 4-tert-butylbenzoyl isothiocyanate, 4-(tert-butyl)benzene-1-carbonyl isothiocyanate, 4-t-butylbenzoyl isothiocyanate, 4-(tert-Butyl)benzoyl isothiocyanate, 4-(tert-butyl)-benzoyl isothiocyanate, 4-tert-butylbenzoylisothiocyanate, ISBLKWMZWUQAJN-UHFFFAOYSA-N
Isomers (same molecular formula)
imino(diphenyl)-lambda4-sulfane;hydrate C12H13NOS
3-cyclopropyl-2-phenyl-1,3-thiazolidin-4-one C12H13NOS
[2-oxo-2-(2,4,6-trimethylphenyl)ethyl] thiocyanate C12H13NOS
[2-(3,5-dimethylphenyl)-1,3-thiazol-4-yl]methanol C12H13NOS
(2Z)-2-(thiophen-2-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one C12H13NOS
spiro[1,3-thiazolidine-2,3'-2,4-dihydro-1H-naphthalene]-4-one C12H13NOS
(2E)-2-(thiophen-2-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one C12H13NOS
3-(1-benzothiophen-3-yl)morpholine C12H13NOS
2-(2-thiophen-2-ylethoxy)aniline C12H13NOS
2-(3-methoxyphenyl)-4,5-dimethyl-1,3-thiazole C12H13NOS
ethyl 1-oxo-2,3-dihydroindene-4-carboximidothioate C12H13NOS
1-ethyl-6-methoxyquinoline-2-thione C12H13NOS