| |
| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
| |
|
|
| IUPAC name : | [(4Z)-1-cyclooct-4-enyl] methyl carbonate |
| InChI : | InChI=1/C10H16O3/c1-12-10(11)13-9-7-5-3-2-4-6-8-9/h2-3,9H,4-8H2,1H3/b3-2- |
| InChIKey : | LDHHCYCOENSXIM-IHWYPQMZBZ |
| SMILES : | COC(=O)OC1CCC\C=C/CC1 |
| (EINECS) number : | 401-620-8 |
| cas number : | 87731-18-8 |
| molar refractivity : | 49.78 ± 0.4 cm3 |
| parachor : | 432.3 ± 6.0 cm3 |
| index of refraction : | 1.468 ± 0.03 |
| surface tension : | 34.1 ± 5.0 dyne/cm |
| density : | 1.02 ± 0.1 g/cm3 |
| polarizability : | 19.73 ± 0.5 10-24cm3 |
| xlogp : | 2.90 |
| molecular weight : | 184.2322400 |
| formula : | C10 H16 O3 |
|
|
| |
| |
| fda reg : | unspecified |
h. number : | unspecified |
| organoleptics : | |
| odor type : | floral |
| odor strength : | high ,
recommend smelling in a 10.00 % solution or less |
odor description¹ :
at 10.00 % in dipropylene glycol. | floral violet green banana tagette fruity |
| substantivity : | 19 hour(s) at 100.00 % |
| properties : | |
| appearence : | colorless to pale yellow clear liquid |
| assay : | 68.00 - 78.00 %
|
| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.05600 - 1.06400 @ 25.00 °C.
|
| pounds per gallon - calc. : | 8.787 to 8.854
|
| refractive index : | 1.46300 - 1.46900 @ 20.00 °C.
|
| logp : | 2.45 |
| safety : | |
| most important hazard(s) : |
Xi - Irritant |
| | |
| Oral Toxicity(LD50) : |
Not determined
|
| Dermal Toxicity(LD50) : |
Not determined
|
| | |
| flash point ( Deg. F. ) : | > 212.00 °F. TCC ( > 100.00 °C. )
|
| | |
| recommendation for violet methyl carbonate usage levels up to : |
| | 2.0000 % in the fragrance concentrate.
|
| | |
| recommendation for violet methyl carbonate usage levels up to : |
| | not for flavor use.
|
| | |
| safety links : | |
| (EINECS) number : | 401-620-8 |
| chemidplus : | EE4016208 |
| epa-srs : | 87731-18-8 |
| | |
| other : | |
| |
|
| references : | |
| pubchem : | 201381 |
| | |
| reference : | Luebke, William tgsc, (2006)¹ |