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| IUPAC name : | 1-ethoxy-3,7-dimethyloctane |
| InChI : | InChI=1/C12H26O/c1-5-13-10-9-12(4)8-6-7-11(2)3/h11-12H,5-10H2,1-4H3 |
| InChIKey : | HCHHIPCZJSRFRT-UHFFFAOYAT |
| SMILES : | CCOCCC(C)CCCC(C)C |
| (EINECS) number : | 245-237-2 |
| cas number : | 22810-10-2 |
| molar refractivity : | 59.30 ± 0.3 cm3 |
| parachor : | 524.0 ± 4.0 cm3 |
| index of refraction : | 1.421 ± 0.02 |
| surface tension : | 25.2 ± 3.0 dyne/cm |
| density : | 0.797 ± 0.06 g/cm3 |
| polarizability : | 23.51 ± 0.5 10-24cm3 |
| xlogp : | 5.10 |
| molecular weight : | 186.3342400 |
| formula : | C12 H26 O |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
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organoleptics :
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| odor type : | floral |
| odor strength : | medium |
odor description : at 100.00 %. | fresh clean rose citrus green |
| substantivity : | 64 Hour(s) |
properties :
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| appearence : | colorless clear liquid |
| assay : | 90.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.80800 to 0.81900 @ 25.00 °C.
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| pounds per gallon - calc. : | 6.723 to 6.815
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| specific gravity : | 0.80900 to 0.82000 @ 20.00 °C.
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| pounds per gallon - calc. : | 6.740 to 6.831
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| refractive index : | 1.43500 to 1.44500 @ 20.00 °C.
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| logp : | 4.86 |
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. ) : | 184.00 °F. TCC ( 84.44 °C. )
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| recommendation for dihydrocitronellyl ethyl ether usage levels up to : |
| | 15.0000 % in the fragrance concentrate.
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| recommendation for dihydrocitronellyl ethyl ether 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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| | 1-ethoxy-3,7-dimethyloctane
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| (EINECS) number : | 245-237-2 |
| chemidplus : | 022810102 |
| EPA Substance Registry Services : | 22810-10-2 |
| NLM Chemical Carcinogenesis Research Information System : | 22810-10-2 |
| NLM Developmental and Reproductive Toxicity : | 22810-10-2 |
| NLM Env. Mutagen Info. Center : | 22810-10-2 |
| NLM GENetic TOXicology : | 22810-10-2 |
references :
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| | 1-ethoxy-3,7-dimethyloctane
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| pubchem : | 667591 |
other :
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