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| IUPAC name : | methyl nonanoate |
| InChI : | InChI=1/C10H20O2/c1-3-4-5-6-7-8-9-10(11)12-2/h3-9H2,1-2H3 |
| InChIKey : | IJXHLVMUNBOGRR-UHFFFAOYAA |
| SMILES : | CCCCCCCCC(=O)OC |
| (EINECS) number : | 217-052-7 |
| cas number : | 1731-84-6 |
| beilstein number : | 1754521 |
| fema number : | 2724 |
| coe number : | 389 |
| jecfa number : | 179 |
| fl. number : | 09.108 |
| molar refractivity : | 50.15 ± 0.3 cm3 |
| parachor : | 454.7 ± 4.0 cm3 |
| index of refraction : | 1.422 ± 0.02 |
| surface tension : | 28.3 ± 3.0 dyne/cm |
| density : | 0.874 ± 0.06 g/cm3 |
| polarizability : | 19.88 ± 0.5 10-24cm3 |
| xlogp : | 3.90 |
| molecular weight : | 172.2646000 |
| formula : | C10 H20 O2 |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
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Suppliers :
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| Sigma-Aldrich-SAFC : | Methyl nonanoate |
| | ≥97%, Kosher |
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organoleptics :
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| odor type : | fruity |
| odor strength : | medium |
odor description : at 100.00 %. | sweet fruity pear waxy tropical wine |
properties :
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| appearence : | colorless clear oily liquid |
| assay : | 97.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.86400 - 0.88300 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.189 to 7.347
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| refractive index : | 1.41100 - 1.43200 @ 20.00 °C.
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| melting point : | -35.00 - -34.00 °C. @ 760.00 mm Hg
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| boiling point : | 213.00 - 214.00 °C. @ 760.00 mm Hg
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| logp : | 4.32 |
safety :
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| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| Maximised Survey-derived Daily Intakes (MSDI-EU) : | 0.86 (μg/capita/day) |
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| flash point ( Deg. F. ) : | 184.00 °F. TCC ( 84.44 °C. )
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| recommendation for methyl nonanoate usage levels up to : |
| | not for fragrance use.
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| recommendation for methyl nonanoate usage levels up to : |
| | 10.0000 ppm in the flavor.
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safety links :
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| (EINECS) number : | 217-052-7 |
| rtecs : | RA6906000 for 1731-84-6 |
| chemidplus : | 001731846 |
| epa-srs : | 1731-84-6 |
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other :
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references :
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| jecfa number : | 179 |
| fl. number : | 09.108 |
| pubchem : | 158910 |
| NIST Chemistry WebBook : | 4063666182 |
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