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| IUPAC name : | 1-benzofuran-2-carbaldehyde |
| InChI : | InChI=1/C9H6O2/c10-6-8-5-7-3-1-2-4-9(7)11-8/h1-6H |
| InChIKey : | ADDZHRRCUWNSCS-UHFFFAOYAI |
| SMILES : | C1=CC=C2C(=C1)C=C(O2)C=O |
| (EINECS) number : | 224-248-6 |
| cas number : | 4265-16-1 |
| fema number : | 3128 |
| coe number : | 2247 |
| jecfa number : | 751 |
| fl. number : | 13.031 |
| molar refractivity : | 43.14 ± 0.3 cm3 |
| parachor : | 310.1 ± 4.0 cm3 |
| index of refraction : | 1.651 ± 0.02 |
| surface tension : | 47.7 ± 3.0 dyne/cm |
| density : | 1.238 ± 0.06 g/cm3 |
| polarizability : | 17.10 ± 0.5 10-24cm3 |
| xlogp : | 1.80 |
| molecular weight : | 146.1427400 |
| formula : | C9 H6 O2 |
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| fda reg : | unspecified |
h. number : | 2932.19.0000 |
| organoleptics : | |
| odor type : | fruity |
| odor strength : | medium |
odor description :
at 100.00 %. | bitter almond |
| properties : | |
| appearence : | white to pale yellow solid |
| assay : | 98.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| melting point : | 195.00 - 198.00 °C. @ 760.00 mm Hg
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| melting point : | 130.00 - 131.00 °C. @ 13.00 mm Hg
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| boiling point : | 130.00 - 131.00 °C. @ 13.00 mm Hg
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| boiling point : | 135.00 °C. @ 18.00 mm Hg
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| acid value : | 3.00 max. KOH/g
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| logp : | 2.09 |
| safety : | |
| 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 2-benzofuran carboxaldehyde usage levels up to : |
| | 0.5000 % in the fragrance concentrate.
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| recommendation for 2-benzofuran carboxaldehyde usage levels up to : |
| | 20.0000 ppm in the flavor.
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| safety links : | |
| (EINECS) number : | 224-248-6 |
| rtecs : | DF6490000 for 4265-16-1 |
| chemidplus : | 004265161 |
| epa-srs : | 4265-16-1 |
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| other : | |
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| references : | |
| pubchem : | 197609 |
| NIST Chemistry WebBook : | 1829831019 |
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