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| IUPAC name : | 3-methyldisulfanylprop-1-ene |
| InChI : | InChI=1/C4H8S2/c1-3-4-6-5-2/h3H,1,4H2,2H3 |
| InChIKey : | XNZOTQPMYMCTBZ-UHFFFAOYAP |
| SMILES : | CSSCC=C |
| (EINECS) number : | 218-549-1 |
| cas number : | 2179-58-0 |
| fema number : | 3127 |
| coe number : | 11866 |
| jecfa number : | 568 |
| fl. number : | 12.037 |
| molar refractivity : | 36.29 ± 0.3 cm3 |
| parachor : | 281.6 ± 4.0 cm3 |
| index of refraction : | 1.529 ± 0.02 |
| surface tension : | 32.8 ± 3.0 dyne/cm |
| density : | 1.022 ± 0.06 g/cm3 |
| polarizability : | 14.39 ± 0.5 10-24cm3 |
| xlogp : | 1.90 |
| molecular weight : | 120.2363200 |
| formula : | C4 H8 S2 |
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| fda reg : | unspecified |
h. number : | unspecified |
| organoleptics : | |
| odor type : | sulfurous |
| odor strength : | high ,
recommend smelling in a 0.10 % solution or less |
odor description :
at 0.10 % in propylene glycol. | alliaceous garlic green onion |
| properties : | |
| appearence : | colorless to pale yellow clear liquid |
| assay : | 80.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.02700 - 1.03700 @ 20.00 °C.
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| pounds per gallon - calc. : | 8.556 to 8.639
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| refractive index : | 1.53300 - 1.53500 @ 20.00 °C.
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| boiling point : | 30.00 - 33.00 °C. @ 20.00 mm Hg
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| boiling point : | 83.00 - 84.00 °C. @ 170.00 mm Hg
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| logp : | 2.60 |
| safety : | |
| most important hazard(s) : |
Xi - Irritant |
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| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 95.00 °F. TCC ( 35.00 °C. )
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| IFRA purity specification : | < 0.1% free allyl alcohol |
| recommendation for allyl methyl disulfide usage levels up to : |
| | not for fragrance use.
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| recommendation for allyl methyl disulfide usage levels up to : |
| | 1.0000 ppm in the flavor.
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| safety links : | |
| (EINECS) number : | 218-549-1 |
| chemidplus : | 002179580 |
| epa-srs : | 2179-58-0 |
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| other : | |
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| references : | |
| pubchem : | 203839 |
| NIST Chemistry WebBook : | 1629221776 |
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