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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | nonyl benzoate |
| InChI : | InChI=1/C16H24O2/c1-2-3-4-5-6-7-11-14-18-16(17)15-12-9-8-10-13-15/h8-10,12-13H,2-7,11,14H2,1H3 |
| InChIKey : | VUHMHACHBVTPMF-UHFFFAOYAK |
| SMILES : | CCCCCCCCCOC(=O)C1=CC=CC=C1 |
| (EINECS) number : | 226-691-0 |
| cas number : | 5451-95-6 |
| molar refractivity : | 75.08 ± 0.3 cm3 |
| parachor : | 630.4 ± 4.0 cm3 |
| index of refraction : | 1.490 ± 0.02 |
| surface tension : | 34.8 ± 3.0 dyne/cm |
| density : | 0.957 ± 0.06 g/cm3 |
| polarizability : | 29.76 ± 0.5 10-24cm3 |
| xlogp : | 6.20 |
| molecular weight : | 248.3605600 |
| formula : | C16 H24 O2 |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
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organoleptics :
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| odor type : | balsamic |
| odor strength : | medium |
odor description : at 100.00 %. | myrrh sweet orange wintergreen |
properties :
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| appearence : | colorless clear liquid |
| assay : | 96.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.96200 @ 25.00 °C.
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| boiling point : | 315.00 °C. @ 760.00 mm Hg
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| logp : | 6.45 |
safety :
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| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 287.00 °F. TCC ( 141.67 °C. )
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| recommendation for nonyl benzoate usage levels up to : |
| | 2.0000 % in the fragrance concentrate.
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| recommendation for nonyl benzoate usage levels up to : |
| | not for flavor use.
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safety links :
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| (EINECS) number : | 226-691-0 |
| chemidplus : | 005451956 |
| epa-srs : | 5451-95-6 |
| dtp/nci : | 21881 |
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other :
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references :
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| pubchem : | 656551 |
| NIST Chemistry WebBook : | 2455086571 |
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