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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | 3-methyl-7-propan-2-ylbicyclo[2.2.2]oct-2-ene-5-carbaldehyde |
| InChI : | InChI=1/C13H20O/c1-8(2)12-6-13-9(3)4-10(12)5-11(13)7-14/h4,7-8,10-13H,5-6H2,1-3H3 |
| InChIKey : | OWFZJSXGDOTWSH-UHFFFAOYAG |
| SMILES : | CC1=CC2CC(C1CC2C(C)C)C=O |
| (EINECS) number : | 267-308-7 |
| cas number : | 67845-30-1 |
| molar refractivity : | 59.72 ± 0.3 cm3 |
| parachor : | 474.2 ± 6.0 cm3 |
| index of refraction : | 1.531 ± 0.02 |
| surface tension : | 36.5 ± 3.0 dyne/cm |
| density : | 0.996 ± 0.06 g/cm3 |
| polarizability : | 23.67 ± 0.5 10-24cm3 |
| xlogp : | 4.00 |
| molecular weight : | 192.2973000 |
| formula : | C13 H20 O |
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| fda reg : | unspecified |
h. number : | unspecified |
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| organoleptics : | |
| odor type : | green |
| odor strength : | high , recommend smelling in a 1.00 % solution or less |
odor description : at 1.00 % in dipropylene glycol. | sharp grassy oily green |
| substantivity : | 400 Hour(s) |
| properties : | |
| appearence : | yellow clear liquid |
| assay : | 96.00 - 100.00 % sum of isomers
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.96300 @ 25.00 °C.
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| boiling point : | 262.00 - 263.00 °C. @ 760.00 mm Hg
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| logp : | 3.97 |
| safety : | |
| Oral Toxicity(LD50) : |
Not determined
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | > 200.00 °F. TCC ( > 93.33 °C. )
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| recommendation for bark carbaldehyde usage levels up to : |
| | 0.5000 % in the fragrance concentrate.
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| recommendation for bark carbaldehyde usage levels up to : |
| | not for flavor use.
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| safety links : | |
| (EINECS) number : | 267-308-7 |
| chemidplus : | 067845301 |
| epa-srs : | 67845-30-1 |
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| other : | |
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| references : | |
| pubchem : | 684080 |
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