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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | 2-methylsulfanyl-3-propan-2-ylpyrazine |
| InChI : | InChI=1/C8H12N2S/c1-6(2)7-8(11-3)10-5-4-9-7/h4-6H,1-3H3 |
| InChIKey : | MUSIVZZZFRJWGI-UHFFFAOYAG |
| SMILES : | CC(C)C1=NC=CN=C1SC |
| (EINECS) number : | 267-913-6 |
| cas number : | 67952-59-4 |
| coe number : | 11342 |
| fl. number : | 14.122 |
| molar refractivity : | 48.85 ± 0.4 cm3 |
| parachor : | 403.5 ± 6.0 cm3 |
| index of refraction : | 1.539 ± 0.03 |
| surface tension : | 45.0 ± 5.0 dyne/cm |
| density : | 1.08 ± 0.1 g/cm3 |
| polarizability : | 19.36 ± 0.5 10-24cm3 |
| xlogp : | 1.70 |
| molecular weight : | 168.2592800 |
| formula : | C8 H12 N2 S |
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| fda reg : | unspecified |
h. number : | unspecified |
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| organoleptics : | |
| odor strength : | very high ,
recommend smelling in a 0.01 % solution or less |
odor description :
at 0.01 % in propylene glycol. | powerful green vegetable |
| properties : | |
| appearence : | pale yellow clear liquid |
| assay : | 94.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| boiling point : | 246.00 - 247.00 °C. @ 760.00 mm Hg
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| logp : | 2.60 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 216.00 °F. TCC ( 102.22 °C. )
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| recommendation for 2-isopropyl-3-(methyl thio) pyrazine usage levels up to : |
| | 0.0300 % in the fragrance concentrate.
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| safety links : | |
| (EINECS) number : | 267-913-6 |
| chemidplus : | 067952594 |
| epa-srs : | 67952-59-4 |
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| other : | |
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| references : | |
| fl. number : | 14.122 |
| pubchem : | 683513 |
| NIST Chemistry WebBook : | 2892407142 |
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