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| IUPAC name : | 1-(3,4,5,6-tetrahydropyridin-2-yl)ethanone |
| InChI : | InChI=1/C7H11NO/c1-6(9)7-4-2-3-5-8-7/h2-5H2,1H3 |
| InChIKey : | GNZWXNKZMHJXNU-UHFFFAOYAY |
| SMILES : | CC(=O)C1=NCCCC1 |
| cas number : | 27300-27-2 |
| fl. number : | 14.079 |
| molar refractivity : | 35.97 ± 0.5 cm3 |
| parachor : | 287.7 ± 8.0 cm3 |
| index of refraction : | 1.524 ± 0.05 |
| surface tension : | 35.8 ± 7.0 dyne/cm |
| density : | 1.06 ± 0.1 g/cm3 |
| polarizability : | 14.26 ± 0.5 10-24cm3 |
| xlogp : | 0.30 |
| molecular weight : | 125.1683400 |
| formula : | C7 H11 N O |
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| fda reg : | unspecified |
h. number : | unspecified |
| organoleptics : | |
| odor strength : | high ,
recommend smelling in a 0.01 % solution or less |
odor description :
at 0.01 % in propylene glycol. | caramel |
| properties : | |
| assay : | 95.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| boiling point : | 200.00 - 203.00 °C. @ 760.00 mm Hg
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| logp : | -0.71 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 171.00 °F. TCC ( 77.22 °C. )
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| recommendation for 2-acetyl-3,4,5,6-tetrahydropyridine usage levels up to : | | | 0.0500 % in the fragrance concentrate.
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| safety links : | |
| chemidplus : | 27300-27-2 |
| epa-srs : | 27300-27-2 |
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| other : | |
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| references : | |
| fl. number : | 14.079 |
| pubchem : | 10516535 |
| NIST Chemistry WebBook : | 175904866 |
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| synonyms : |
| 2- | acetyl-3,4,5,6-tetrahydropyridine | | 1-(3,4,5,6- | tetrahydro-2-pyridinyl) ethanone |
| soluble in : |
| | alcohol |
| insoluble in : |
| | water |
| natural occurrence in : |
| not found in nature |
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