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| IUPAC name : | 1-(3,4-dimethoxyphenyl)ethanone |
| InChI : | InChI=1/C10H12O3/c1-7(11)8-4-5-9(12-2)10(6-8)13-3/h4-6H,1-3H3 |
| InChIKey : | IQZLUWLMQNGTIW-UHFFFAOYAO |
| SMILES : | CC(=O)C1=CC(=C(C=C1)OC)OC |
| (EINECS) number : | 214-468-0 |
| cas number : | 1131-62-0 |
| beilstein number : | 0781213 |
| molar refractivity : | 49.63 ± 0.3 cm3 |
| parachor : | 405.7 ± 4.0 cm3 |
| index of refraction : | 1.499 ± 0.02 |
| surface tension : | 33.2 ± 3.0 dyne/cm |
| density : | 1.066 ± 0.06 g/cm3 |
| polarizability : | 19.67 ± 0.5 10-24cm3 |
| xlogp : | 1.40 |
| molecular weight : | 180.2004800 |
| formula : | C10 H12 O3 |
| BioActivity Analysis : | 81722 |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
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Suppliers :
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| Sigma-Aldrich-SAFC : | 3',4'-Dimethoxyacetophenone |
| | ≥98% |
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organoleptics :
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| odor type : | woody |
| odor strength : | medium , recommend smelling in a 10.00 % solution or less |
odor description : at 10.00 % in dipropylene glycol. | sweet woody floral |
properties :
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| appearence : | white to pale yellow clear liquid |
| assay : | 98.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| refractive index : | 1.54300 @ 20.00 °C.
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| melting point : | 49.00 - 51.00 °C. @ 760.00 mm Hg
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| boiling point : | 286.00 - 288.00 °C. @ 760.00 mm Hg
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| logp : | 1.32 |
safety :
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| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | > 230.00 °F. TCC ( > 110.00 °C. )
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| recommendation for 3',4'-dimethoxyacetophenone usage levels up to : |
| | 0.5000 % in the fragrance concentrate.
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safety links :
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| (EINECS) number : | 214-468-0 |
| chemidplus : | 001131620 |
| epa-srs : | 1131-62-0 |
| dtp/nci : | 18708 |
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other :
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references :
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| pubchem : | 157614 |
| NIST Chemistry WebBook : | 820947878 |
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