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| IUPAC name : | methoxybenzene |
| InChI : | InChI=1/C7H8O/c1-8-7-5-3-2-4-6-7/h2-6H,1H3 |
| InChIKey : | RDOXTESZEPMUJZ-UHFFFAOYAP |
| SMILES : | COC1=CC=CC=C1 |
| (EINECS) number : | 202-876-1 |
| cas number : | 100-66-3 |
| fema number : | 2097 |
| coe number : | 2056 |
| jecfa number : | 1241 |
| fl. number : | 04.032 |
| molar refractivity : | 32.93 ± 0.3 cm3 |
| parachor : | 263.9 ± 4.0 cm3 |
| index of refraction : | 1.492 ± 0.02 |
| surface tension : | 29.3 ± 3.0 dyne/cm |
| density : | 0.953 ± 0.06 g/cm3 |
| polarizability : | 13.05 ± 0.5 10-24cm3 |
| xlogp : | 1.90 |
| molecular weight : | 108.1378200 |
| formula : | C7 H8 O |
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| fda reg : | 172.515 |
h. number : | 2909.30.0000 |
| organoleptics : | |
| odor type : | phenolic |
| odor strength : | high ,
recommend smelling in a 1.00 % solution or less |
odor description :
at 1.00 % in dipropylene glycol. | phenolic gasoline ethereal anise |
| substantivity : | 4 Hour(s) |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 99.00 - 100.00 %
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| Food Chemicals Codex Listed : | Yes |
| specific gravity : | 0.99000 - 0.99300 @ 25.00 °C.
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| pounds per gallon - calc. : | 8.238 to 8.263
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| refractive index : | 1.51500 - 1.51800 @ 20.00 °C.
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| melting point : | 37.00 - 38.00 °C. @ 760.00 mm Hg
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| boiling point : | 155.00 °C. @ 760.00 mm Hg
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| logp : | 2.11 |
| safety : | |
| Oral Toxicity(LD50) : |
Oral-Rat 3700.00 mg/kg
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 125.00 °F. TCC ( 51.67 °C. )
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| recommendation for anisole usage levels up to : |
| | 0.6000 % in the fragrance concentrate.
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| recommendation for anisole usage levels up to : |
| | 50.0000 ppm in the flavor.
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| safety links : | |
| (EINECS) number : | 202-876-1 |
| rtecs : | BZ8050000 for 100-66-3 |
| chemidplus : | 000100663 |
| epa-srs : | 100-66-3 |
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| other : | |
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| references : | |
| pubchem : | 150596 |
| NIST Chemistry WebBook : | 4152707363 |
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