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1098-97-1

1098-97-1 Structure

1098-97-1 Structure
IdentificationMore
[Name]

PYRITHIOXIN
[CAS]

1098-97-1
[Synonyms]

5-[[5-HYDROXY-4-(HYDROXYMETHYL)-6-METHYL-PYRIDIN-3-YL]METHYLDISULFANYLMETHYL]-4-(HYDROXYMETHYL)-2-METHYL-PYRIDIN-3-OL
PYRITHIOXIN
PYRITHIOXINE
PYRITINOL
3,3’-(dithiobis(methylene))bis(5-hydroxy-6-methyl-4-pyridinemethano
3,3’-(dithiobis(methylene))bis(5-hydroxy-6-methyl-4-pyridinemethanol)
3,3’-(dithiodimethylene)bis(5-hydroxy-6-methyl-4-pyridinemethano
biocefalin
bonol
dipyridoxolyldisulfide
encefabol
epocan
pyridoxine-5-disulfide
pyridoxinedisulfide
vitaminb6disulfide
bis(5-hydroxy-4-hydroxymethyl-6-methyl-3-pyridylmethyl) disulphide
pyrithioxin free base
Bis-[(3-Hydroxy-4-Hydroxymethyl-2-Methyl-5-Pyridyl)-Methyl]-Disulfide
PYRITINOL (PYRITHIOXINE) BASE
PYRITINOL (PYRITHIOXINE) HCL
[EINECS(EC#)]

214-150-1
[Molecular Formula]

C16H20N2O4S2
[MDL Number]

MFCD00151477
[Molecular Weight]

368.47
[MOL File]

1098-97-1.mol
Chemical PropertiesBack Directory
[Melting point ]

218-220°
[Boiling point ]

742.8±60.0 °C(Predicted)
[density ]

1.448±0.06 g/cm3(Predicted)
[storage temp. ]

Keep in dark place,Inert atmosphere,Room temperature
[solubility ]

Soluble in DMSO
[form ]

neat
[pka]

9.31±0.10(Predicted)
[color ]

White to Light yellow to Light orange
[Merck ]

14,7996
[InChI]

InChI=1S/C16H20N2O4S2/c1-9-15(21)13(5-19)11(3-17-9)7-23-24-8-12-4-18-10(2)16(22)14(12)6-20/h3-4,19-22H,5-8H2,1-2H3
[InChIKey]

SIXLXDIJGIWWFU-UHFFFAOYSA-N
[SMILES]

S(CC1=C(CO)C(O)=C(C)N=C1)SCC1=C(CO)C(O)=C(C)N=C1
[CAS DataBase Reference]

1098-97-1(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)Exclamation Mark (GHS07)
GHS05,GHS07
[Signal word ]

Danger
[Hazard statements ]

H315-H318-H335
[Precautionary statements ]

P261-P280-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26
[WGK Germany ]

2
[RTECS ]

UT4836666
[HS Code ]

2936.25.0000
Hazard InformationBack Directory
[Description]

Pyritinol, the disulfide of pyridoxine-5-thiol, is marketed as a cerebral stimulant in Europe. Both the thiol and the disulfide have been shown to have d-penicillamine-like activity in the treatment of rheumatoid arthritis. Adverse effects are similar to those seen with d-penicillamine. Occasionally, pyritinol seems effective and better tolerated in some individuals who fail to respond to d-penicillamine.
[Uses]

cognition enhancer, nootropic
[Uses]

Pyritinol can be used as a nootropic used in the prevention and treatment of cerebrovascular diseases.
[Definition]

ChEBI: Pyritinol is a member of methylpyridines.
[Brand name]

Biontabol;Bonifwn;Cefalogen;Cerebrotrofina;Cervitalin;Divalvon-d;Enbol;Encefort;Encerbrovit;Encerebron;Fulneurina;Geribolina;Gerontabol comp.;Juniormen;Leonar;Logos;Maind;Musa;Neuroxin;Piriditol;Piririomin;Piritinol;Piritiomin;Plenumil;Sawaxin;Scintidin;Tibased;Tomevit;Tonobrein;Tonomentis.
[World Health Organization (WHO)]

Pyritinol, which is claimed to promote the uptake of glucose in the brain, is used in the treatment of cerebrovascular disorders. However, WHO is not aware of controlled experimental data to show that it has any therapeutic effect.
[Synthesis]

Synthesis: treatment of pyridoxine with hydrobromic acid gives 4,5-bis(bromomethyl)-3- hydroxy-2-methylpyridinium bromide, which when treated in the cold with potassium ethyl xanthate gives ethyl 4-hydroxymethyl- 3-hydroxy-2-methyl-3-pyridyl methylxanthate. Hydrolysis and oxidation are carried out in aqueous-alcoholic ammonia to give the disulfide pyritinol.
PYRITHIOXIN synthesis
Spectrum DetailBack Directory
[Spectrum Detail]

PYRITHIOXIN(1098-97-1)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

1098-97-1(sigmaaldrich)
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