| |
| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
| |
|
|
| IUPAC name : | 3-methoxy-5-methylphenol |
| InChI : | InChI=1/C8H10O2/c1-6-3-7(9)5-8(4-6)10-2/h3-5,9H,1-2H3 |
| InChIKey : | NOTCZLKDULMKBR-UHFFFAOYAR |
| SMILES : | CC1=CC(=CC(=C1)OC)O |
| cas number : | 3209-13-0 |
| (EINECS) number : | 221-716-1 |
| molar refractivity : | 39.63 ± 0.3 cm3 |
| parachor : | 316.6 ± 4.0 cm3 |
| index of refraction : | 1.530 ± 0.02 |
| surface tension : | 37.2 ± 3.0 dyne/cm |
| density : | 1.078 ± 0.06 g/cm3 |
| polarizability : | 15.71 ± 0.5 10-24cm3 |
| XlogP : | 2.00 |
| molecular weight : | 138.1638000 (IUPAC) |
| formula : | C8 H10 O2 |
| NMR Predictor : | Predict |
|
|
| |
| |
| export tariff code : | unspecified |
| fda reg : | unspecified |
Suppliers :
|
| Givaudan : | Orcinyl 3
Odor: Oakmoss, Sweet, Phenolic |
| Vigon : | Orcinyl-3
Odor: FRUITY, OAKMOSS |
organoleptics :
|
| odor type : | mossy |
| odor strength : | medium , recommend smelling in a 10.00 % solution or less |
odor description :¹ at 10.00 % in dipropylene glycol. | oakmoss fruity iodine woody hay |
| odor sample from : | Roure Bertrand Dupont Inc. |
| substantivity : | 400 Hour(s) |
properties :
|
| appearence : | white to tan powder |
| assay : | 98.00 to 100.00 %
|
| Food Chemicals Codex Listed : | No |
| boiling point : | 254.00 to 255.00 °C. @ 760.00 mm Hg
|
| flash point : | 275.00 °F. TCC ( 135.00 °C. )
|
| logP (o/w) : | 1.98 |
safety :
|
| most important hazard(s) : | Xn - Harmful. |
| |
R 22 - Harmful if swallowed. R 36/38 - Irritating to skin and eyes. S 02 - Keep out of the reach of children. S 24/25 - Avoid contact with skin and eyes. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 37/39 - Wear suitable gloves and eye/face protection.
|
| Oral Toxicity(LD50) : |
| |
Oral-Rat 1500.00 mg/kg
|
| Dermal Toxicity(LD50) : |
| |
Not determined
|
| Inhalation Toxicity(LC50) : |
| |
Not determined
|
| |
safety in use :
|
| |
| recommendation for oakmoss phenol usage levels up to : |
| | 1.0000 % in the fragrance concentrate.
|
| recommendation for oakmoss phenol usage levels up to : |
| | not for flavor use.
|
safety references :
|
| EPI System : | view |
| Canada Domestic Sub. List : | Yes |
| EPA Chem. Sub. Inventory : | Yes |
| |
| WGK Germany : | 3 |
| |
| |
| |
| | 3-methoxy-5-methylphenol
|
| (EINECS) number : | 221-716-1 |
| chemidplus : | 003209130 |
| EPA Substance Registry Services : | 3209-13-0 |
references :
|
| | 3-methoxy-5-methylphenol
|
| pubchem : | 653747 |
Cosmetics :
|
| Cosmetic uses : |
perfuming agents
|
other :
|
| reference : | Luebke, William tgsc, (1985)¹ |
| CosIng : | cosmetic data |