S-methyl methioninium chloride
 
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IUPAC name :(3-amino-4-hydroxy-4-oxobutyl)-dimethylsulfanium chloride
InChI :InChI=1/C6H13NO2S.ClH/c1-10(2)4-3-5(7)6(8)9;/h5H,3-4,7H2,1-2H3;1H/fC6H14NO2S.Cl/h8H;1h/q+1;-1
InChIKey :MYGVPKMVGSXPCQ-APCIKCDMCC
SMILES :C[S+](C)CCC(C(=O)O)N.[Cl-]
(EINECS) number :214-231-1
cas number :1115-84-0
fema number :3445
coe number :761
jecfa number :1427
fl. number :17.015
molecular weight : 199.6988600
formula :C6 H14 N O2 S Cl
 
 
export tariff code :2936.90.0000
fda reg :unspecified
 
 

organoleptics :
odor strength :medium
odor description :
at 100.00 %.  
malty tomato potato sulfury green

properties :
appearence :white crystalline powder
assay : 98.00 - 100.00 %   
Food Chemicals Codex Listed :No
melting point : 134.00 - 139.00 °C. @ 760.00 mm Hg
logp : 0.28

safety :
Oral Toxicity(LD50) : Oral-Rat    >6.00  gm/kg    
Dermal Toxicity(LD50) : Not determined
  
flash point ( Deg. F. ) :not determined
  
recommendation for S-methyl methioninium chloride usage levels up to :
 not for fragrance use.
  
recommendation for S-methyl methioninium chloride usage levels up to :
  5.0000 ppm in the flavor.
  

safety links :
(EINECS) number :214-231-1
chemidplus :001115840
epa-srs :1115-84-0
  

other :
 

references :
jecfa number :1427
fl. number :17.015
pubchem :157505
  
synonyms :
(S)-(3-amino-3-carboxypropyl) dimethyl sulfonium chloride
laevo-(3-amino-3-carboxypropyl) dimethyl sulfonium chloride
laevo-(S)-(3-amino-3-carboxypropyl) dimethyl sulfonium chloride
laevo-methyl methionine sulfonum chloride
S-methyl methioninium chloride
S-methylmethioninesulphonium chloride
 vitamin U
soluble in :
 alcohol
 water
(odor and/or flavor) blends with :
 acetoin
 acetoin acetate
 acetyl butyryl
 acetyl isobutyryl
 acetyl isovaleryl
 acetyl nonyryl
 acetyl propionyl
 allyl methyl trisulfide
 allyl nonanoate
6-amyl-alpha-pyrone
 benzylidene acetone
isobutyl benzyl carbinol
 butyl butyryl lactate
 butyl lactate
 butyl laevo-lactate
2-isobutyl thiazole
 butyraldehyde
 butyric acid
2-oxobutyric acid
gamma-butyrolactone
 coconut decanone
 creamy lactone
 dairy lactone
delta-decalactone
gamma-decalactone
6-decenoic acid
 diacetyl
2,5-dihydroxy-1,4-dithiane
1,2-dimethoxybenzene
 dimethyl sulfide
delta-2-dodecenolactone
2-ethyl furan
 ethyl methyl mercaptopropionate
 ethyl methyl sulfide
 ethyl palmitate
 ethyl undecylenate
 ethyl vanillin
 ethyl vanillin isobutyrate
 ethyl vanillin propylene glycol acetal
 farnesyl acetone
 geranium thiazole
laevo-glutamine
 heptanal 2,3-butane diol acetal
(Z)-4-hepten-1-al
(Z)-4-hepten-1-al diethyl acetal
(Z)-4-hepten-1-ol
1-hepten-3-ol
3-heptyl dihydro-5-methyl-2(3H)-furanone
3-hexen-1-al
(E)-4-hexen-1-ol
(Z)-4-hexen-1-ol
 levulinic acid
 massoia lactone
 methional
 methyl (Z)-5-octenoate
 methyl 2-thiofuroate
 methyl 3-(methyl thio) propionate
6-methyl coumarin
 methyl laurate
4-methyl octanoic acid
 methyl propyl disulfide
bis(methyl thio) methane
 methyl thiol isovalerate
 mint lactone
delta-nonalactone
2-nonanol
1-nonen-3-ol
2,4-octadien-1-ol
gamma-octalactone
3-octen-2-ol
 octyl 2-furoate
 octyl isobutyrate
(E)-2-penten-1-al
 potato butanone
 strawberry furanone acetate
delta-tetradecalactone
delta-undecalactone
gamma-undecalactone
 undecanoic acid
 vanilla oleoresin
 vanillic acid
 vanillin
 vanillyl acetate
 vanillyl alcohol
 vanillyl isobutyrate
 vanillylidene acetone
(odor and/or flavor) used in :
 corn
 potato
 tomato
 vegetable
natural occurrence in :
not found in nature



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