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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | 2-butan-2-yl-1,3-thiazole |
| InChI : | InChI=1/C7H11NS/c1-3-6(2)7-8-4-5-9-7/h4-6H,3H2,1-2H3 |
| InChIKey : | MHJSWOZJMPIGJQ-UHFFFAOYAF |
| SMILES : | CCC(C)C1=NC=CS1 |
| (EINECS) number : | 242-154-3 |
| cas number : | 18277-27-5 |
| fema number : | 3372 |
| coe number : | 11598 |
| jecfa number : | 1033 |
| fl. number : | 15.022 |
| molar refractivity : | 41.54 ± 0.3 cm3 |
| parachor : | 339.4 ± 4.0 cm3 |
| index of refraction : | 1.510 ± 0.02 |
| surface tension : | 35.8 ± 3.0 dyne/cm |
| density : | 1.018 ± 0.06 g/cm3 |
| polarizability : | 16.47 ± 0.5 10-24cm3 |
| xlogp : | 1.60 |
| molecular weight : | 141.2339400 |
| formula : | C7 H11 N S |
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| IUPAC name : | 2-[(2R)-butan-2-yl]-1,3-thiazole |
| InChI : | InChI=1/C7H11NS/c1-3-6(2)7-8-4-5-9-7/h4-6H,3H2,1-2H3/t6-/m1/s1 |
| InChIKey : | MHJSWOZJMPIGJQ-ZCFIWIBFBE |
| SMILES : | CC[C@@H](C)C1=NC=CS1 |
| cas number : | 18277-27-5 |
| molar refractivity : | 41.54 ± 0.3 cm3 |
| parachor : | 339.4 ± 4.0 cm3 |
| index of refraction : | 1.510 ± 0.02 |
| surface tension : | 35.8 ± 3.0 dyne/cm |
| density : | 1.018 ± 0.06 g/cm3 |
| polarizability : | 16.47 ± 0.5 10-24cm3 |
| xlogp : | 1.60 |
| molecular weight : | 141.2339400 |
| formula : | C7 H11 N S |
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| IUPAC name : | 2-[(2S)-butan-2-yl]-1,3-thiazole |
| InChI : | InChI=1/C7H11NS/c1-3-6(2)7-8-4-5-9-7/h4-6H,3H2,1-2H3/t6-/m0/s1 |
| InChIKey : | MHJSWOZJMPIGJQ-LURJTMIEBC |
| SMILES : | CC[C@H](C)C1=NC=CS1 |
| cas number : | 18277-27-5 |
| molar refractivity : | 41.54 ± 0.3 cm3 |
| parachor : | 339.4 ± 4.0 cm3 |
| index of refraction : | 1.510 ± 0.02 |
| surface tension : | 35.8 ± 3.0 dyne/cm |
| density : | 1.018 ± 0.06 g/cm3 |
| polarizability : | 16.47 ± 0.5 10-24cm3 |
| xlogp : | 1.60 |
| molecular weight : | 141.2339400 |
| formula : | C7 H11 N S |
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| fda reg : | unspecified |
h. number : | 2934.10.0000 |
| organoleptics : | |
| odor type : | green |
| odor strength : | high ,
recommend smelling in a 0.10 % solution or less |
odor description :
at 0.10 % in dipropylene glycol. | raw green herbal |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 98.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.00100 @ 25.00 °C.
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| refractive index : | 1.49500 @ 20.00 °C.
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| boiling point : | 174.00 - 175.00 °C. @ 760.00 mm Hg
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| logp : | 2.51 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 139.00 °F. TCC ( 59.44 °C. )
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| recommendation for 2-sec-butyl thiazole usage levels up to : |
| | 0.0500 % in the fragrance concentrate.
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| recommendation for 2-sec-butyl thiazole usage levels up to : |
| | 1.0000 ppm in the flavor.
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| safety links : | |
| (EINECS) number : | 242-154-3 |
| chemidplus : | 018277275 |
| epa-srs : | 18277-27-5 |
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| chemidplus : | 18277-27-5 |
| epa-srs : | 18277-27-5 |
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| chemidplus : | 18277-27-5 |
| epa-srs : | 18277-27-5 |
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| other : | |
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| references : | |
| pubchem : | 204625 |
| NIST Chemistry WebBook : | 2754300279 |
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| pubchem : | 39321689 |
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| pubchem : | 36888668 |
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