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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | 1-[3,7-dimethyl-1-(11-methyldodecoxy)oct-6-enoxy]-11-methyldodecane |
| InChI : | InChI=1/C36H72O2/c1-32(2)25-20-16-12-8-10-14-18-22-29-37-36(31-35(7)28-24-27-34(5)6)38-30-23-19-15-11-9-13-17-21-26-33(3)4/h27,32-33,35-36H,8-26,28-31H2,1-7H3 |
| InChIKey : | IOROHSYUWTZOFC-UHFFFAOYAY |
| SMILES : | CC(C)CCCCCCCCCCOC(CC(C)CCC=C(C)C)OCCCCCCCCCCC(C)C |
| (EINECS) number : | 267-786-7 |
| cas number : | 67923-82-4 |
| molar refractivity : | 172.05 ± 0.3 cm3 |
| parachor : | 1476.6 ± 4.0 cm3 |
| index of refraction : | 1.458 ± 0.02 |
| surface tension : | 30.1 ± 3.0 dyne/cm |
| density : | 0.851 ± 0.06 g/cm3 |
| polarizability : | 68.20 ± 0.5 10-24cm3 |
| xlogp : | 13.70 |
| molecular weight : | 536.9556800 |
| formula : | C36 H72 O2 |
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| export tariff code : | 2911.00.5000 |
| fda reg : | unspecified |
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organoleptics :
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| odor strength : | medium , recommend smelling in a 10.00 % solution or less |
odor description : at 10.00 % in dipropylene glycol. | fresh rose fruity minty |
properties :
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| appearence : | pale yellow clear liquid |
| assay : | 94.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| logp : | 16.40 |
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. ) : | not determined
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| recommendation for citronellal diisotridecyl acetal usage levels up to : |
| | 1.0000 % in the fragrance concentrate.
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| recommendation for citronellal diisotridecyl acetal usage levels up to : |
| | not for flavor use.
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safety links :
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| (EINECS) number : | 267-786-7 |
| chemidplus : | 067923824 |
| EPA Substance Registry Services : | 67923-82-4 |
| NLM Chemical Carcinogenesis Research Information System : | 67923-82-4 |
| NLM Developmental and Reproductive Toxicity : | 67923-82-4 |
| NLM Env. Mutagen Info. Center : | 67923-82-4 |
| NLM GENetic TOXicology : | 67923-82-4 |
| EPI System : | view |
other :
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references :
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| pubchem : | 683463 |