| |
| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
| |
|
|
| IUPAC name : | 2-methyl-1,3-dithiolane |
| InChI : | InChI=1/C4H8S2/c1-4-5-2-3-6-4/h4H,2-3H2,1H3 |
| InChIKey : | CARJCVDELAMAEJ-UHFFFAOYAD |
| SMILES : | CC1SCCS1 |
| (EINECS) number : | 227-038-2 |
| cas number : | 5616-51-3 |
| fema number : | 3705 |
| jecfa number : | 534 |
| fl. number : | 15.034 |
| molar refractivity : | 34.86 ± 0.3 cm3 |
| parachor : | 270.5 ± 4.0 cm3 |
| index of refraction : | 1.561 ± 0.02 |
| surface tension : | 39.8 ± 3.0 dyne/cm |
| density : | 1.116 ± 0.06 g/cm3 |
| polarizability : | 13.82 ± 0.5 10-24cm3 |
| xlogp : | 1.90 |
| molecular weight : | 120.2363200 |
| formula : | C4 H8 S2 |
| BioActivity Analysis : | 132071 |
|
|
| |
| |
| fda reg : | unspecified |
h. number : | unspecified |
| organoleptics : | |
| odor type : | sulfurous |
| odor strength : | high ,
recommend smelling in a 0.10 % solution or less |
odor description :
at 0.10 % in propylene glycol. | sulfurous alliaceous smoky savory vegetable |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 96.00 - 100.00 %
|
| Food Chemicals Codex Listed : | No |
| specific gravity : | 1.14700 - 1.15700 @ 20.00 °C.
|
| pounds per gallon - calc. : | 9.555 to 9.639
|
| refractive index : | 1.55900 - 1.56900 @ 20.00 °C.
|
| boiling point : | 65.00 °C. @ 10.00 mm Hg
|
| logp : | 1.20 |
| safety : | |
| most important hazard(s) : |
Xi - Irritant |
| | |
| Oral Toxicity(LD50) : |
Not determined
|
| Dermal Toxicity(LD50) : |
Not determined
|
| | |
| flash point ( Deg. F. ) : | 111.00 °F. TCC ( 43.89 °C. )
|
| | |
| recommendation for 2-methyl-1,3-dithiolane usage levels up to : |
| | not for fragrance use.
|
| | |
| safety links : | |
| (EINECS) number : | 227-038-2 |
| chemidplus : | 005616513 |
| epa-srs : | 5616-51-3 |
| dtp/nci : | 227863 |
| | |
| other : | |
| |
|
| references : | |
| jecfa number : | 534 |
| fl. number : | 15.034 |
| pubchem : | 164536 |
| NIST Chemistry WebBook : | 3397916041 |
| | |