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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | 3-[(2S)-6-methylhept-5-en-2-yl]-6-methylidenecyclohexene |
| InChI : | InChI=1/C15H24/c1-12(2)6-5-7-14(4)15-10-8-13(3)9-11-15/h6,8,10,14-15H,3,5,7,9,11H2,1-2,4H3/t14-,15u/m0/s1 |
| InChIKey : | PHWISBHSBNDZDX-MLCCFXAWBV |
| SMILES : | C[C@@H](CCC=C(C)C)C1CCC(=C)C=C1 |
| cas number : | 20307-83-9 |
| molar refractivity : | 68.53 ± 0.4 cm3 |
| parachor : | 554.1 ± 6.0 cm3 |
| index of refraction : | 1.482 ± 0.03 |
| surface tension : | 28.3 ± 5.0 dyne/cm |
| density : | 0.85 ± 0.1 g/cm3 |
| polarizability : | 27.17 ± 0.5 10-24cm3 |
| xlogp : | 4.70 |
| molecular weight : | 204.3510600 |
| formula : | C15 H24 |
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| export tariff code : | unspecified |
| 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 100.00 %. | herbal fruity woody |
properties :
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| appearence : | colorless to pale yellow clear liquid |
| assay : | 96.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| boiling point : | 270.00 to 272.00 °C. @ 760.00 mm Hg
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| logp : | 6.52 |
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. ) : | 226.00 °F. TCC ( 107.78 °C. )
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| recommendation for beta-sesquiphellandrene usage levels up to : |
| | 3.0000 % in the fragrance concentrate.
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safety references :
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| EPI System : | view |
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| | 3-[(2S)-6-methylhept-5-en-2-yl]-6-methylidenecyclohexene
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| chemidplus : | 20307-83-9 |
| EPA Substance Registry Services : | 20307-83-9 |
| NLM Chemical Carcinogenesis Research Information System : | 20307-83-9 |
| NLM Developmental and Reproductive Toxicity : | 20307-83-9 |
| NLM Env. Mutagen Info. Center : | 20307-83-9 |
| NLM GENetic TOXicology : | 20307-83-9 |
references :
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| | 3-[(2S)-6-methylhept-5-en-2-yl]-6-methylidenecyclohexene
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| pubchem : | 39294549 |
other :
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