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| IUPAC name : | (E)-hex-2-enal |
| InChI : | InChI=1/C6H10O/c1-2-3-4-5-6-7/h4-6H,2-3H2,1H3/b5-4+ |
| InChIKey : | MBDOYVRWFFCFHM-SNAWJCMRBX |
| SMILES : | CCC\C=C\C=O |
| cas number : | 85761-70-2 |
| fema number : | 2560 |
| molar refractivity : | 30.09 ± 0.3 cm3 |
| parachor : | 266.9 ± 4.0 cm3 |
| index of refraction : | 1.421 ± 0.02 |
| surface tension : | 25.7 ± 3.0 dyne/cm |
| density : | 0.828 ± 0.06 g/cm3 |
| polarizability : | 11.92 ± 0.5 10-24cm3 |
| xlogp : | 1.90 |
| molecular weight : | 98.1430000 |
| formula : | C6 H10 O |
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| IUPAC name : | (Z)-hex-2-enal |
| InChI : | InChI=1/C6H10O/c1-2-3-4-5-6-7/h4-6H,2-3H2,1H3/b5-4- |
| InChIKey : | MBDOYVRWFFCFHM-PLNGDYQABQ |
| SMILES : | CCC\C=C/C=O |
| cas number : | 16635-54-4 |
| fema number : | 2560 |
| coe number : | 2128 |
| molar refractivity : | 30.09 ± 0.3 cm3 |
| parachor : | 266.9 ± 4.0 cm3 |
| index of refraction : | 1.421 ± 0.02 |
| surface tension : | 25.7 ± 3.0 dyne/cm |
| density : | 0.828 ± 0.06 g/cm3 |
| polarizability : | 11.92 ± 0.5 10-24cm3 |
| xlogp : | 1.90 |
| molecular weight : | 98.1430000 |
| formula : | C6 H10 O |
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| IUPAC name : | hex-2-enal |
| InChI : | InChI=1/C6H10O/c1-2-3-4-5-6-7/h4-6H,2-3H2,1H3 |
| InChIKey : | MBDOYVRWFFCFHM-UHFFFAOYAV |
| SMILES : | CCCC=CC=O |
| (EINECS) number : | 208-014-0 |
| cas number : | 505-57-7 |
| beilstein number : | 1740988 |
| fema number : | 2560 |
| coe number : | 748 |
| jecfa number : | |
| fl. number : | 05.189 |
| molar refractivity : | 30.09 ± 0.3 cm3 |
| parachor : | 266.9 ± 4.0 cm3 |
| index of refraction : | 1.421 ± 0.02 |
| surface tension : | 25.7 ± 3.0 dyne/cm |
| density : | 0.828 ± 0.06 g/cm3 |
| polarizability : | 11.92 ± 0.5 10-24cm3 |
| xlogp : | 1.90 |
| molecular weight : | 98.1430000 |
| formula : | C6 H10 O |
| BioActivity Analysis : | 48414801 |
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| fda reg : | unspecified |
h. number : | unspecified |
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| organoleptics : | |
| odor strength : | high ,
recommend smelling in a 0.10 % solution or less |
odor description :
at 0.10 % in dipropylene glycol. | green leafy |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 92.00 - 100.00 % sum of isomers
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| Food Chemicals Codex Listed : | No |
| boiling point : | 141.00 - 143.00 °C. @ 760.00 mm Hg
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| logp : | 1.58 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 118.00 °F. TCC ( 47.78 °C. )
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| recommendation for (E)-2-hexen-1-al usage levels up to : |
| | 0.5000 % in the fragrance concentrate.
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| safety links : | |
| chemidplus : | 006728263 |
| epa-srs : | 85761-70-2 |
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| chemidplus : | 016635544 |
| epa-srs : | 16635-54-4 |
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| (EINECS) number : | 208-014-0 |
| rtecs : | MP5900000 for 505-57-7 |
| chemidplus : | 000505577 |
| epa-srs : | 505-57-7 |
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| other : | |
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| references : | |
| pubchem : | 165763 |
| NIST Chemistry WebBook : | 147808639 |
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| pubchem : | 170494 |
| NIST Chemistry WebBook : | 3156192092 |
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| jecfa number : | |
| fl. number : | 05.189 |
| pubchem : | 153745 |
| NIST Chemistry WebBook : | 1994515338 |
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