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| IUPAC name : | 2,2-bis[(2E)-3,7-dimethylocta-2,6-dienoxy]ethylbenzene |
| InChI : | InChI=1/C28H42O2/c1-23(2)12-10-14-25(5)18-20-29-28(22-27-16-8-7-9-17-27)30-21-19-26(6)15-11-13-24(3)4/h7-9,12-13,16-19,28H,10-11,14-15,20-22H2,1-6H3/b25-18+,26-19+ |
| InChIKey : | KJTMVMCIPAJMOH-XUWUHCBVBE |
| SMILES : | CC(=CCC/C(=C/COC(CC1=CC=CC=C1)OC\C=C(/C)\CCC=C(C)C)/C)C |
| (EINECS) number : | 266-805-6 |
| cas number : | 67634-02-0 |
| molar refractivity : | 131.51 ± 0.3 cm3 |
| parachor : | 1049.8 ± 4.0 cm3 |
| index of refraction : | 1.510 ± 0.02 |
| surface tension : | 32.6 ± 3.0 dyne/cm |
| density : | 0.935 ± 0.06 g/cm3 |
| polarizability : | 52.13 ± 0.5 10-24cm3 |
| xlogp : | 6.40 |
| molecular weight : | 410.6318800 |
| formula : | C28 H42 O2 |
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| export tariff code : | 2911.00.5000 |
| fda reg : | unspecified |
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organoleptics :
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| odor type : | floral |
| odor strength : | medium |
odor description : at 100.00 %. | floral rose absolute geranium balsam |
properties :
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| appearence : | pale yellow clear viscous liquid |
| assay : | 96.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.94300 to 0.95000 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.847 to 7.905
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| specific gravity : | 0.94400 to 0.95100 @ 20.00 °C.
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| pounds per gallon - calc. : | 7.864 to 7.922
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| refractive index : | 1.51200 to 1.51800 @ 20.00 °C.
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| acid value : | 1.00 max. KOH/g
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| logp : | 10.24 |
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. ) : | > 212.00 °F. TCC ( > 100.00 °C. )
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| recommendation for phenyl acetaldehyde digeranyl acetal usage levels up to : |
| | 10.0000 % in the fragrance concentrate.
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| recommendation for phenyl acetaldehyde digeranyl acetal usage levels up to : |
| | not for flavor use.
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safety references :
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| EPI System : | view |
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| | 2,2-bis[(2E)-3,7-dimethylocta-2,6-dienoxy]ethylbenzene
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| (EINECS) number : | 266-805-6 |
| chemidplus : | 067634020 |
| EPA Substance Registry Services : | 67634-02-0 |
| NLM Chemical Carcinogenesis Research Information System : | 67634-02-0 |
| NLM Developmental and Reproductive Toxicity : | 67634-02-0 |
| NLM Env. Mutagen Info. Center : | 67634-02-0 |
| NLM GENetic TOXicology : | 67634-02-0 |
| dtp/nci : | 72020 |
references :
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| | 2,2-bis[(2E)-3,7-dimethylocta-2,6-dienoxy]ethylbenzene
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| pubchem : | 682948 |
other :
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