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| IUPAC name : | 2-(4-methylcyclohexyl)propan-2-yl acetate |
| InChI : | InChI=1/C12H22O2/c1-9-5-7-11(8-6-9)12(3,4)14-10(2)13/h9,11H,5-8H2,1-4H3 |
| InChIKey : | HBNHCGDYYBMKJN-UHFFFAOYAL |
| SMILES : | CC1CCC(CC1)C(C)(C)OC(=O)C |
| (EINECS) number : | 261-543-9 |
| cas number : | 58985-18-5 |
| fl. number : | 09.617 |
| molar refractivity : | 56.98 ± 0.3 cm3 |
| parachor : | 498.8 ± 6.0 cm3 |
| index of refraction : | 1.448 ± 0.02 |
| surface tension : | 30.2 ± 3.0 dyne/cm |
| density : | 0.932 ± 0.06 g/cm3 |
| polarizability : | 22.58 ± 0.5 10-24cm3 |
| xlogp : | 4.10 |
| molecular weight : | 198.3018800 |
| formula : | C12 H22 O2 |
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| fda reg : | unspecified |
h. number : | 2915.39.9050 |
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| organoleptics : | |
| odor type : | herbal |
| odor strength : | medium |
odor description : at 100.00 %. | pine citrus woody lime cologne |
| substantivity : | 4 Hour(s) |
| properties : | |
| appearence : | pale yellow clear liquid |
| assay : | 96.00 - 100.00 % sum of isomers
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.93600 - 0.94100 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.788 to 7.830
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| specific gravity : | 0.93100 - 0.93900 @ 20.00 °C.
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| pounds per gallon - calc. : | 7.756 to 7.823
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| refractive index : | 1.44700 - 1.45300 @ 20.00 °C.
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| acid value : | 1.00 max. KOH/g
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| logp : | 3.96 |
| safety : | |
| 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 dihydroterpinyl acetate usage levels up to : |
| | 10.0000 % in the fragrance concentrate.
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| recommendation for dihydroterpinyl acetate usage levels up to : |
| | not for flavor use.
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| safety links : | |
| (EINECS) number : | 261-543-9 |
| chemidplus : | 000080251 |
| epa-srs : | 58985-18-5 |
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| other : | |
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| references : | |
| fl. number : | 09.617 |
| pubchem : | 149607 |
| NIST Chemistry WebBook : | 775273783 |
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