| |
| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
| |
|
|
| IUPAC name : | (3E)-undeca-1,3-dien-5-yne |
| InChI : | InChI=1/C11H16/c1-3-5-7-9-11-10-8-6-4-2/h3,5,7H,1,4,6,8,10H2,2H3/b7-5+ |
| InChIKey : | VJCOQIJZYGQPKM-FNORWQNLBQ |
| SMILES : | CCCCCC#C\C=C\C=C |
| cas number : | 166432-52-6 |
| molar refractivity : | 50.79 ± 0.3 cm3 |
| parachor : | 424.1 ± 4.0 cm3 |
| index of refraction : | 1.469 ± 0.02 |
| surface tension : | 29.4 ± 3.0 dyne/cm |
| density : | 0.813 ± 0.06 g/cm3 |
| polarizability : | 20.13 ± 0.5 10-24cm3 |
| xlogp : | 5.00 |
| molecular weight : | 148.2447400 |
| formula : | C11 H16 |
|
|
| |
| |
| IUPAC name : | (3Z)-undeca-1,3-dien-5-yne |
| InChI : | InChI=1/C11H16/c1-3-5-7-9-11-10-8-6-4-2/h3,5,7H,1,4,6,8,10H2,2H3/b7-5- |
| InChIKey : | VJCOQIJZYGQPKM-ALCCZGGFBW |
| SMILES : | CCCCCC#C\C=C/C=C |
| cas number : | 166432-52-6 |
| molar refractivity : | 50.79 ± 0.3 cm3 |
| parachor : | 424.1 ± 4.0 cm3 |
| index of refraction : | 1.469 ± 0.02 |
| surface tension : | 29.4 ± 3.0 dyne/cm |
| density : | 0.813 ± 0.06 g/cm3 |
| polarizability : | 20.13 ± 0.5 10-24cm3 |
| xlogp : | 5.00 |
| molecular weight : | 148.2447400 |
| formula : | C11 H16 |
|
|
| |
| |
| fda reg : | unspecified |
h. number : | unspecified |
| organoleptics : | |
| odor type : | green |
| odor strength : | high ,
recommend smelling in a 1.00 % solution or less |
odor description :
at 1.00 % in dipropylene glycol. | fruity green violet leaf galbanum |
| properties : | |
| appearence : | colorless to pale yellow clear liquid |
| assay : | 96.00 - 100.00 %
|
| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.84500 - 0.85500 @ 25.00 °C.
|
| pounds per gallon - calc. : | 7.031 to 7.114
|
| refractive index : | 1.44000 - 1.44400 @ 20.00 °C.
|
| acid value : | 1.00 max. KOH/g
|
| logp : | 4.64 |
| safety : | |
| most important hazard(s) : |
Xi - Irritant |
| | |
| Oral Toxicity(LD50) : |
Oral-Rat >2000.00 mg/kg
|
| Dermal Toxicity(LD50) : |
Not determined
|
| | |
| flash point ( Deg. F. ) : | 171.00 °F. TCC ( 77.22 °C. )
|
| | |
| recommendation for violet dienyne usage levels up to : |
| | 1.0000 % in the fragrance concentrate.
|
| | |
| recommendation for violet dienyne usage levels up to : |
| | not for flavor use.
|
| | |
| safety links : | |
| chemidplus : | 166432526 |
| epa-srs : | 166432-52-6 |
| | |
| chemidplus : | 166432-52-6 |
| epa-srs : | 166432-52-6 |
| | |
| other : | |
| |
|
| references : | |
| pubchem : | 10549606 |
| | |
| pubchem : | 34094219 |
| | |