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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | (2-methyl-6-methylideneoct-7-en-2-yl) acetate |
| InChI : | InChI=1/C12H20O2/c1-6-10(2)8-7-9-12(4,5)14-11(3)13/h6H,1-2,7-9H2,3-5H3 |
| InChIKey : | DCXXKSXLKWAZNO-UHFFFAOYAI |
| SMILES : | CC(=O)OC(C)(C)CCCC(=C)C=C |
| (EINECS) number : | 214-262-0 |
| cas number : | 1118-39-4 |
| % from : | 20.00% to 40.00% |
| beilstein number : | 1768049 |
| coe number : | 10857 |
| fl. number : | 09.669 |
| molar refractivity : | 58.67 ± 0.3 cm3 |
| parachor : | 503.5 ± 4.0 cm3 |
| index of refraction : | 1.445 ± 0.02 |
| surface tension : | 27.3 ± 3.0 dyne/cm |
| density : | 0.891 ± 0.06 g/cm3 |
| polarizability : | 23.26 ± 0.5 10-24cm3 |
| xlogp : | 3.80 |
| molecular weight : | 196.2860000 |
| formula : | C12 H20 O2 |
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| IUPAC name : | 2-(4-methyl-1-cyclohex-3-enyl)propan-2-yl acetate |
| InChI : | InChI=1/C12H20O2/c1-9-5-7-11(8-6-9)12(3,4)14-10(2)13/h5,11H,6-8H2,1-4H3 |
| InChIKey : | IGODOXYLBBXFDW-UHFFFAOYAB |
| SMILES : | CC1CCC(C=C1)(C(C)C)OC(=O)C |
| (EINECS) number : | 201-265-7 |
| cas number : | 80-26-2 |
| % from : | 5.00% to 25.00% |
| beilstein number : | 3198769 |
| fema number : | 3047 |
| coe number : | 205 |
| fl. number : | 09.015 |
| molar refractivity : | 57.29 ± 0.4 cm3 |
| parachor : | 486.4 ± 6.0 cm3 |
| index of refraction : | 1.467 ± 0.03 |
| surface tension : | 30.8 ± 5.0 dyne/cm |
| density : | 0.95± 0.1 g/cm3 |
| polarizability : | 22.71 ± 0.5 10-24cm3 |
| xlogp : | 3.10 |
| molecular weight : | 196.2860000 |
| formula : | C12 H20 O2 |
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| fda reg : | unspecified |
h. number : | 2915.39.9050 |
| organoleptics : | |
| odor type : | citrus |
| odor strength : | medium |
odor description :
at 100.00 %. | citrus bergamot lavender floral woody nutmeg |
| substantivity : | 6 hour(s) at 100.00 % |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 80.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.90400 - 0.91200 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.522 to 7.589
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| specific gravity : | 0.90500 - 0.91300 @ 20.00 °C.
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| pounds per gallon - calc. : | 7.539 to 7.606
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| refractive index : | 1.45600 - 1.46100 @ 20.00 °C.
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| boiling point : | 256.00 - 257.00 °C. @ 760.00 mm Hg
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| logp : | 3.66 |
| safety : | |
| Oral Toxicity(LD50) : |
Oral-Rat 63000.00 mg/kg
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| Dermal Toxicity(LD50) : |
Skin-Rabbit >5.00 gm/kg
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| flash point ( Deg. F. ) : | 180.00 °F. TCC ( 82.22 °C. )
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| recommendation for myrcenyl acetate usage levels up to : |
| | 20.0000 % in the fragrance concentrate.
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| recommendation for myrcenyl acetate usage levels up to : |
| | not for flavor use.
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| safety links : | |
| (EINECS) number : | 214-262-0 |
| chemidplus : | 001118394 |
| epa-srs : | 1118-39-4 |
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| (EINECS) number : | 201-265-7 |
| rtecs : | OT0200000 for 80-26-2 |
| chemidplus : | 008007350 |
| epa-srs : | 80-26-2 |
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| other : | |
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| references : | |
| fl. number : | 09.669 |
| pubchem : | 157520 |
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| fl. number : | 09.015 |
| pubchem : | 688299 |
| NIST Chemistry WebBook : | 2687434629 |
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