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| IUPAC name : | ethyl 3-cyclohexyl-3-hydroxypropanoate |
| InChI : | InChI=1/C11H14O3/c1-2-14-11(13)8-10(12)9-6-4-3-5-7-9/h3-7,10,12H,2,8H2,1H3 |
| InChIKey : | DVIBDQWVFHDBOP-UHFFFAOYAJ |
| SMILES : | CCOC(=O)CC(C1=CC=CC=C1)O |
| (EINECS) number : | 227-288-2 |
| cas number : | 5764-85-2 |
| molar refractivity : | 53.01 ± 0.3 cm3 |
| parachor : | 443.3 ± 4.0 cm3 |
| index of refraction : | 1.523 ± 0.02 |
| surface tension : | 42.6 ± 3.0 dyne/cm |
| density : | 1.119 ± 0.06 g/cm3 |
| polarizability : | 21.01 ± 0.5 10-24cm3 |
| xlogp : | 1.60 |
| molecular weight : | 194.2270600 |
| formula : | C11 H14 O3 |
| BioActivity Analysis : | 131449 |
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| fda reg : | unspecified |
h. number : | 2915.50.3000 |
| organoleptics : | |
| odor type : | fruity |
| odor strength : | medium |
odor description :
at 100.00 %. | fruity leather strawberry dry straw |
| substantivity : | 284 Hour(s) |
| properties : | |
| appearence : | colorless to pale yellow clear liquid |
| assay : | 90.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.09200 - 1.10000 @ 25.00 °C.
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| pounds per gallon - calc. : | 9.087 to 9.153
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| specific gravity : | 1.09300 - 1.10100 @ 20.00 °C.
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| pounds per gallon - calc. : | 9.105 to 9.172
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| refractive index : | 1.50700 - 1.51300 @ 20.00 °C.
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| logp : | 1.36 |
| safety : | |
| most important hazard(s) : |
Xi - Irritant |
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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. ) : | > 212.00 °F. TCC ( > 100.00 °C. )
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| recommendation for leather propionate usage levels up to : |
| | 5.0000 % in the fragrance concentrate.
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| recommendation for leather propionate usage levels up to : |
| | not for flavor use.
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| safety links : | |
| (EINECS) number : | 227-288-2 |
| chemidplus : | 005764852 |
| epa-srs : | 5764-85-2 |
| dtp/nci : | 226071 |
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| other : | |
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| references : | |
| pubchem : | 677177 |
| NIST Chemistry WebBook : | 15020907 |
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