ChemNet > CAS > 22457-89-2 S-benzoylthiamine O-monophosphate

22457-89-2 S-benzoylthiamine O-monophosphate

Nom	S-benzoylthiamine O-monophosphate
Nom anglais	S-benzoylthiamine O-monophosphate; Benfotiamine; n-((4-amino-2-methyl-5-pyrimidinyl)methyl)-n-(4-hydroxy-2-mercapto-1-methyl-1-butenyl)formamide-s-benzoate dihydrogen phosphate; S-[2-{[(4-amino-2-methylpyrimidin-5-yl)methyl](formyl)amino}-5-(phosphonooxy)pent-2-en-3-yl] benzenecarbothioate; S-{(1Z)-2-{[(4-amino-2-methylpyrimidin-5-yl)methyl](formyl)amino}-1-[2-(phosphonooxy)ethyl]prop-1-en-1-yl} benzenecarbothioate; S-{(1E)-2-{[(4-amino-2-methylpyrimidin-5-yl)methyl](formyl)amino}-1-[2-(phosphonooxy)ethyl]prop-1-en-1-yl} benzenecarbothioate
Formule moléculaire	C₁₉H₂₃N₄O₆PS
Poids Moléculaire	466.4479
InChI	InChI=1/C19H23N4O6PS/c1-13(23(12-24)11-16-10-21-14(2)22-18(16)20)17(8-9-29-30(26,27)28)31-19(25)15-6-4-3-5-7-15/h3-7,10,12H,8-9,11H2,1-2H3,(H2,20,21,22)(H2,26,27,28)/b17-13+
Numéro de registre CAS	22457-89-2
EINECS	245-013-4
Structure moléculaire
Densité	1.444g/cm³
Point d'ébullition	745.1°C at 760 mmHg
Indice de réfraction	1.645
Point d'éclair	404.4°C
Pression de vapeur	2.55E-23mmHg at 25°C
Les symboles de danger
Codes des risques
Description de sécurité

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