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| IUPAC name : | 1-(benzoyloxy)propan-2-yl benzoate |
| InChI : | InChI=1/C17H16O4/c1-13(21-17(19)15-10-6-3-7-11-15)12-20-16(18)14-8-4-2-5-9-14/h2-11,13H,12H2,1H3 |
| InChIKey : | UMVMVEZHMZTUHD-UHFFFAOYAP |
| SMILES : | CC(COC(=O)C1=CC=CC=C1)OC(=O)C2=CC=CC=C2 |
| (EINECS) number : | 242-894-7 |
| cas number : | 19224-26-1 |
| fema number : | 3419 |
| coe number : | 10890 |
| jecfa number : | 862 |
| fl. number : | 09.803 |
| molar refractivity : | 78.59 ± 0.3 cm3 |
| parachor : | 629.2 ± 4.0 cm3 |
| index of refraction : | 1.560 ± 0.02 |
| surface tension : | 44.9 ± 3.0 dyne/cm |
| density : | 1.169 ± 0.06 g/cm3 |
| polarizability : | 31.15 ± 0.5 10-24cm3 |
| xlogp : | 4.20 |
| molecular weight : | 284.3065400 |
| formula : | C17 H16 O4 |
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| fda reg : | 175.105 |
h. number : | unspecified |
| organoleptics : | |
| odor type : | ethereal |
| odor strength : | medium |
odor description¹ :
at 100.00 %. | salmon algae metallic shellfish |
| substantivity : | 7 hour(s) at 100.00 % |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 96.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.15700 - 1.16300 @ 25.00 °C.
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| pounds per gallon - calc. : | 9.627 to 9.677
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| refractive index : | 1.54200 - 1.54700 @ 20.00 °C.
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| melting point : | -3.00 °C. @ 760.00 mm Hg
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| boiling point : | 232.00 °C. @ 12.00 mm Hg
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| acid value : | 1.00 max. KOH/g
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| logp : | 4.83 |
| shelf life : | 24.00 month(s) or longer if stored properly. |
| storage : | store in cool, dry place in tightly sealed containers, protected from heat and light. |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | > 230.00 °F. TCC ( > 110.00 °C. )
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| recommendation for propylene glycol dibenzoate usage levels up to : |
| | not for fragrance use.
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| recommendation for propylene glycol dibenzoate usage levels up to : |
| | 85.0000 ppm in the flavor.
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| safety links : | |
| (EINECS) number : | 242-894-7 |
| chemidplus : | 19224-26-1 |
| epa-srs : | 19224-26-1 |
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| other : | |
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| references : | |
| pubchem : | 10512095 |
| NIST Chemistry WebBook : | 4205826121 |
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| reference : | Luebke, William tgsc, (2007)¹ |