Benfotiamine

Cat. No.: PI22457892

Product Details Other Identifiers Computed Properties

CAS	22457-89-2
Synonyms	Benzoic acid,thio-,S-ester with N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-(4-hydroxy-2-mercapto-1-methyl-1-butenyl)formamide dihydrogen phosphate (ester)
Molecular Formula	C19H23N4O6PS
Molecular Weight	466.45
Density	1.4±0.1 g/cm3
Melting Point	165 °C (decomp)
Boiling Point	745.1 °C at 760 mmHg
Flash Point	404.4±35.7 °C
Refractive Index	1.645
Vapor Pressure	2.55E-23 mmHg at 25 °C
Storage Conditions	2-8 °C

EC Number

245-013-4

XLogP3	0.5
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	10
Exact Mass	466.10759264
Monoisotopic Mass	466.10759264
Heavy Atom Count	31
Complexity	697
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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