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| IUPAC name : | 3-(4-methoxyphenyl)prop-2-enal |
| InChI : | InChI=1/C10H10O2/c1-12-10-6-4-9(5-7-10)3-2-8-11/h2-8H,1H3 |
| InChIKey : | AXCXHFKZHDEKTP-UHFFFAOYAQ |
| SMILES : | COC1=CC=C(C=C1)C=CC=O |
| (EINECS) number : | 217-807-0 |
| cas number : | 1963-36-6 |
| fema number : | 3567 |
| coe number : | 11919 |
| jecfa number : | 687 |
| fl. number : | 05.118 |
| molar refractivity : | 49.00 ± 0.3 cm3 |
| parachor : | 375.7 ± 4.0 cm3 |
| index of refraction : | 1.559 ± 0.02 |
| surface tension : | 37.6 ± 3.0 dyne/cm |
| density : | 1.068 ± 0.06 g/cm3 |
| polarizability : | 19.42 ± 0.5 10-24cm3 |
| xlogp : | 1.90 |
| molecular weight : | 162.1852000 |
| formula : | C10 H10 O2 |
| BioActivity Analysis : | 422988 |
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| export tariff code : | 2912.49.0000 |
| fda reg : | unspecified |
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Suppliers :
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| Bedoukian Research : | p-METHOXY CINNAMIC ALDEHYDE (PMCA)
≥98.0%, Kosher |
| Cargill - Alfrebro : | p-METHOXY-CINNAMALDEHYDE
40% in Ethanol, natural, Kosher |
organoleptics :
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| odor type : | spicy |
| odor strength : | medium , recommend smelling in a 10.00 % solution or less |
odor description : at 10.00 % in dipropylene glycol. | spicy cinnamon sweet cherry vanilla floral |
properties :
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| appearence : | yellow crystals |
| assay : | 98.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| melting point : | 44.00 to 45.00 °C. @ 760.00 mm Hg
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| boiling point : | 160.00 °C. @ 3.00 mm Hg
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| boiling point : | 308.00 to 309.00 °C. @ 760.00 mm Hg
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| logp : | 2.07 |
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 para-methoxycinnamaldehyde usage levels up to : |
| | 3.0000 % in the fragrance concentrate.
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| recommendation for para-methoxycinnamaldehyde usage levels up to : |
| | 20.0000 ppm in the flavor.
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safety references :
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| EPI System : | view |
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| | 3-(4-methoxyphenyl)prop-2-enal
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| (EINECS) number : | 217-807-0 |
| chemidplus : | 1963-36-6 |
| EPA Substance Registry Services : | 1963-36-6 |
| NLM Chemical Carcinogenesis Research Information System : | 1963-36-6 |
| NLM Developmental and Reproductive Toxicity : | 1963-36-6 |
| NLM Env. Mutagen Info. Center : | 1963-36-6 |
| NLM GENetic TOXicology : | 1963-36-6 |
| dtp/nci : | 134287 |
references :
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| | 3-(4-methoxyphenyl)prop-2-enal
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| jecfa number : | 687 |
| fl. number : | 05.118 |
| pubchem : | 87316 |
other :
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