Thiamine Benzoate Hydrochloride

• Synonyms:

  Thiamine Benzoate (Ester) Monohydrochloride; 3-[(4-Amino-2-methyl-5-pyrimidinyl)methyl]-5-[2-(benzoyloxy)ethyl]-4-methylthiazolium Chloride Monohydrochloride;

• Hazard Statement:

  No Data Available

• Smiles:

  NC1=NC(C)=NC=C1C[N+]2=CSC(CCOC(C3=CC=CC=C3)=O)=C2C.[Cl-].Cl

• Molecular Formula:

  C19H21N4O2S • HCl • Cl

• Molecular Weight:

  441.37

• InChI:

  InChI=1S/C19H21N4O2S.2ClH/c1-13-17(8-9-25-19(24)15-6-4-3-5-7-15)26-12-23(13)11-16-10-21-14(2)22-18(16)20;;/h3-7,10,12H,8-9,11H2,1-2H3,(H2,20,21,22);2*1H/q+1;;/p-1

• Additionnal Information:

  IUPAC name: 3-((4-amino-2-methylpyrimidin-5-yl)methyl)-5-(2-(benzoyloxy)ethyl)-4-methylthiazol-3-ium chloride hydrochloride

• Shipping Conditions:

  Room Temperature

• CAS Number:

  1052-32-0