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| IUPAC name : | 1-propyldisulfanylprop-1-ene |
| InChI : | InChI=1/C6H12S2/c1-3-5-7-8-6-4-2/h3,5H,4,6H2,1-2H3 |
| InChIKey : | AAPBYIVJOWCMGH-UHFFFAOYAU |
| SMILES : | CCCSS\C=C\C |
| (EINECS) number : | 227-604-9 |
| cas number : | 5905-46-4 |
| fema number : | 3227 |
| coe number : | 11699 |
| jecfa number : | 570 |
| fl. number : | 12.044 |
| molar refractivity : | 45.89 ± 0.3 cm3 |
| parachor : | 359.3 ± 4.0 cm3 |
| index of refraction : | 1.527 ± 0.02 |
| surface tension : | 33.7 ± 3.0 dyne/cm |
| density : | 0.994 ± 0.06 g/cm3 |
| polarizability : | 18.19 ± 0.5 10-24cm3 |
| xlogp : | 3.00 |
| molecular weight : | 148.2894800 |
| formula : | C6 H12 S2 |
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| IUPAC name : | (E)-1-propyldisulfanylprop-1-ene |
| InChI : | InChI=1/C6H12S2/c1-3-5-7-8-6-4-2/h3,5H,4,6H2,1-2H3/b5-3+ |
| InChIKey : | AAPBYIVJOWCMGH-HWKANZROBX |
| SMILES : | CCCSS\C=C\C |
| cas number : | 23838-21-3 |
| molar refractivity : | 45.89 ± 0.3 cm3 |
| parachor : | 359.3 ± 4.0 cm3 |
| index of refraction : | 1.527 ± 0.02 |
| surface tension : | 33.7 ± 3.0 dyne/cm |
| density : | 0.994 ± 0.06 g/cm3 |
| polarizability : | 18.19 ± 0.5 10-24cm3 |
| xlogp : | 3.00 |
| molecular weight : | 148.2894800 |
| formula : | C6 H12 S2 |
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| IUPAC name : | (Z)-1-propyldisulfanylprop-1-ene |
| InChI : | InChI=1/C6H12S2/c1-3-5-7-8-6-4-2/h3,5H,4,6H2,1-2H3/b5-3- |
| InChIKey : | AAPBYIVJOWCMGH-HYXAFXHYBU |
| SMILES : | CCCSS\C=C/C |
| cas number : | 23838-20-2 |
| molar refractivity : | 45.89 ± 0.3 cm3 |
| parachor : | 359.3 ± 4.0 cm3 |
| index of refraction : | 1.527 ± 0.02 |
| surface tension : | 33.7 ± 3.0 dyne/cm |
| density : | 0.994 ± 0.06 g/cm3 |
| polarizability : | 18.19 ± 0.5 10-24cm3 |
| xlogp : | 3.00 |
| molecular weight : | 148.2894800 |
| formula : | C6 H12 S2 |
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| fda reg : | unspecified |
h. number : | unspecified |
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| organoleptics : | |
| odor type : | sulfurous |
| odor strength : | high ,
recommend smelling in a 0.10 % solution or less |
odor description :
at 0.10 % in propylene glycol. | cooked onion |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 92.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| refractive index : | 1.52200 - 1.53200 @ 20.00 °C.
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| boiling point : | 78.00 - 80.00 °C. @ 13.00 mm Hg
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| logp : | 4.08 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 148.00 °F. TCC ( 64.44 °C. )
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| recommendation for propenyl propyl disulfide usage levels up to : |
| | not for fragrance use.
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| recommendation for propenyl propyl disulfide usage levels up to : |
| | 2.0000 ppm in the flavor.
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| safety links : | |
| (EINECS) number : | 227-604-9 |
| chemidplus : | 5905-46-4 |
| epa-srs : | 5905-46-4 |
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| chemidplus : | 005905464 |
| epa-srs : | 23838-21-3 |
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| chemidplus : | 23838-20-2 |
| epa-srs : | 23838-20-2 |
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| other : | |
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| references : | |
| jecfa number : | 570 |
| fl. number : | 12.044 |
| pubchem : | 5905-46-4 |
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| pubchem : | 204083 |
| NIST Chemistry WebBook : | 1928720893 |
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| pubchem : | 11078015 |
| NIST Chemistry WebBook : | 3369824764 |
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