| |
| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
| |
|
|
| IUPAC name : | 2-methylundecanal |
| InChI : | InChI=1/C12H24O/c1-3-4-5-6-7-8-9-10-12(2)11-13/h11-12H,3-10H2,1-2H3 |
| InChIKey : | NFAVNWJJYQAGNB-UHFFFAOYAB |
| SMILES : | CCCCCCCCCC(C)C=O |
| (EINECS) number : | 203-765-0 |
| cas number : | 110-41-8 |
| beilstein number : | 1758291 |
| fema number : | 2749 |
| coe number : | 2010 |
| jecfa number : | 275 |
| fl. number : | 05.077 |
| molar refractivity : | 57.78 ± 0.3 cm3 |
| parachor : | 515.8 ± 4.0 cm3 |
| index of refraction : | 1.428 ± 0.02 |
| surface tension : | 27.9 ± 3.0 dyne/cm |
| density : | 0.821 ± 0.06 g/cm3 |
| polarizability : | 22.90 ± 0.5 10-24cm3 |
| xlogp : | 5.40 |
| molecular weight : | 184.3183600 |
| formula : | C12 H24 O |
|
|
| |
| |
| IUPAC name : | (2S)-2-methylundecanal |
| InChI : | InChI=1/C12H24O/c1-3-4-5-6-7-8-9-10-12(2)11-13/h11-12H,3-10H2,1-2H3/t12-/m0/s1 |
| InChIKey : | NFAVNWJJYQAGNB-LBPRGKRZBG |
| SMILES : | CCCCCCCCC[C@H](C)C=O |
| cas number : | 110-41-8 |
| molar refractivity : | 57.78 ± 0.3 cm3 |
| parachor : | 515.8 ± 4.0 cm3 |
| index of refraction : | 1.428 ± 0.02 |
| surface tension : | 27.9 ± 3.0 dyne/cm |
| density : | 0.821 ± 0.06 g/cm3 |
| polarizability : | 22.90 ± 0.5 10-24cm3 |
| xlogp : | 5.40 |
| molecular weight : | 184.3183600 |
| formula : | C12 H24 O |
|
|
| |
| |
| fda reg : | 172.515 |
h. number : | 2912.30.0000 |
| organoleptics : | |
| odor type : | aldehydic |
| odor strength : | high ,
recommend smelling in a 1.00 % solution or less |
odor description :
at 1.00 % in dipropylene glycol. | fresh amber citrus moss tuberose |
| taste description³ : | at 2.00 ppm.
Waxy, fatty, metallic, with citrus nuances |
| substantivity : | 308 hour(s) at 100.00 % |
| properties : | |
| appearence : | colorless to pale yellow clear liquid |
| assay : | 98.00 - 100.00 %
|
| Food Chemicals Codex Listed : | Yes |
| specific gravity : | 0.82200 - 0.83000 @ 25.00 °C.
|
| pounds per gallon - calc. : | 6.840 to 6.906
|
| specific gravity : | 0.82300 - 0.83100 @ 20.00 °C.
|
| pounds per gallon - calc. : | 6.856 to 6.923
|
| refractive index : | 1.43000 - 1.43600 @ 20.00 °C.
|
| boiling point : | 171.00 °C. @ 760.00 mm Hg
|
| boiling point : | 233.00 °C. @ 760.00 mm Hg
|
| acid value : | 2.00 max. KOH/g
|
| logp : | 4.97 |
| shelf life : | 12.00 month(s) or longer if stored properly. |
| storage : | store in cool, dry place in tightly sealed containers, protected from heat and light. store under nitrogen. |
| safety : | |
| most important hazard(s) : |
N - Dangerous for the environment. |
| | |
| Oral Toxicity(LD50) : |
Oral-Rat >5.00 gm/kg FCTXAV 11,485,1973
|
| Dermal Toxicity(LD50) : |
Skin-Rabbit >10.00 gm/kg FCTXAV 11,485,1973
|
| | |
| flash point ( Deg. F. ) : | 200.00 °F. TCC ( 93.33 °C. )
|
| | |
| recommendation for 2-methyl undecanal (aldehyde C-12 mna) usage levels up to : |
| | 2.0000 % in the fragrance concentrate.
|
| | |
| recommendation for 2-methyl undecanal (aldehyde C-12 mna) usage levels up to : |
| | 5.0000 ppm in the flavor.
|
| | |
| safety links : | |
| msds : | msds |
| | |
| (EINECS) number : | 203-765-0 |
| rtecs : | YQ1509000 for 110-41-8 |
| chemidplus : | 000110418 |
| epa-srs : | 110-41-8 |
| dtp/nci : | 46127 |
| | |
| chemidplus : | 110-41-8 |
| epa-srs : | 110-41-8 |
| | |
| other : | |
| |
C of A
|
| references : | |
| pubchem : | 197261 |
| NIST Chemistry WebBook : | 246115750 |
| | |
| pubchem : | 43759832 |
| | |
| reference : | Mosciano, Gerard P&F 19, No. 2, 55, (1994)³ |