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| IUPAC name : | 3,7-dimethylocta-1,6-dien-3-yl 2-aminobenzoate |
| InChI : | InChI=1/C17H23NO2/c1-5-17(4,12-8-9-13(2)3)20-16(19)14-10-6-7-11-15(14)18/h5-7,9-11H,1,8,12,18H2,2-4H3 |
| InChIKey : | WHIJSULEEDNKPD-UHFFFAOYAG |
| SMILES : | CC(=CCCC(C)(C=C)OC(=O)C1=CC=CC=C1N)C |
| (EINECS) number : | 230-472-5 |
| cas number : | 7149-26-0 |
| fema number : | 2637 |
| coe number : | 256 |
| jecfa number : | 1540 |
| fl. number : | 09.721 |
| molar refractivity : | 83.54 ± 0.3 cm3 |
| parachor : | 663.5 ± 4.0 cm3 |
| index of refraction : | 1.538 ± 0.02 |
| surface tension : | 38.2 ± 3.0 dyne/cm |
| density : | 1.024 ± 0.06 g/cm3 |
| polarizability : | 33.12 ± 0.5 10-24cm3 |
| xlogp : | 4.50 |
| molecular weight : | 273.3700200 |
| formula : | C17 H23 N O2 |
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| fda reg : | 172.515 |
h. number : | 2922.49.3800 |
| organoleptics : | |
| odor type : | floral |
| odor strength : | medium |
odor description :
at 100.00 %. | fresh linalool orange blossom woody |
| substantivity : | 336 Hour(s) |
| properties : | |
| appearence : | colorless to pale yellow clear oily liquid |
| assay : | 97.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.99600 - 1.00600 @ 25.00 °C.
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| pounds per gallon - calc. : | 8.288 to 8.371
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| refractive index : | 1.51300 - 1.52300 @ 20.00 °C.
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| boiling point : | 350.00 °C. @ 760.00 mm Hg
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| acid value : | 2.00 max. KOH/g
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| logp : | 5.98 |
| safety : | |
| Oral Toxicity(LD50) : |
Oral-Rat 4250.00 mg/kg
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| Dermal Toxicity(LD50) : |
Skin-Rabbit >5.00 gm/kg
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| flash point ( Deg. F. ) : | 456.00 °F. TCC ( 235.56 °C. )
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| recommendation for linalyl anthranilate usage levels up to : | | | 8.0000 % in the fragrance concentrate.
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| recommendation for linalyl anthranilate usage levels up to : | | | 8.0000 ppm in the flavor.
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| safety links : | |
| (EINECS) number : | 230-472-5 |
| chemidplus : | 007149260 |
| epa-srs : | 7149-26-0 |
| dtp/nci : | 72026 |
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| other : | |
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| references : | |
| pubchem : | 166107 |
| NIST Chemistry WebBook : | 2565959929 |
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| synonyms : |
| | anthranilic acid 1,5-dimethyl-1-vinyl-4-hexenyl ester | | | anthranilic acid linalyl ester | | 1,5- | dimethyl-1-vinyl hex-4-enyl anthranilate | | 1,5- | dimethyl-1-vinyl-4-hexen-1-yl ortho-aminobenzoate | | 1,5- | dimethyl-1-vinyl-4-hexenyl anthranilate | | 3,7- | dimethyl-1,6-octadien-3-ol 2-aminobenzoate | | 3,7- | dimethyl-1,6-octadien-3-yl 2-aminobenzoate | | 3,7- | dimethyl-1,6-octadien-3-yl anthranilate | | 3,7- | dimethyl-1,6-octadien-3-yl ortho-aminobenzoate | | | linalyl anthranilate | | | linalyl ortho-aminobenzoate | | | linalyl-2-aminobenzoate |
| soluble in : |
| | alcohol |
| insoluble in : |
| | water | | | propylene glycol |
| (odor and/or flavor) blends with : |
| | bois de rose oil |
| | petitgrain oil |
| (odor and/or flavor) used in : |
| | cyclamen | | | freesia | | | gardenia | | | jasmin | | | lilac lilas syringa | | | linden blossom limeflower tilleul | | | muguet lily of the valley | | | natural | | | neroli | | | orange blossom fleur d'oranger | | | petitgrain | | | rose | | | sweet pea pois de senteur | | | tuberose tubereuse | | | wistaria wisteria glycine | | | woody |
| natural occurrence in : |
| not found in nature |
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