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| Right Click Picture For More Options. (Safari 1.2 (v125) Compatible). |
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| IUPAC name : | 7,7-dimethyl-4-methylidenebicyclo[3.1.1]heptane |
| InChI : | InChI=1/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8-9H,1,4-6H2,2-3H3 |
| InChIKey : | WTARULDDTDQWMU-UHFFFAOYAW |
| SMILES : | CC1(C2CCC(=C)C1C2)C |
| (EINECS) number : | 204-872-5 |
| cas number : | 127-91-3 |
| fema number : | 2903 |
| coe number : | 2114 |
| jecfa number : | 1330 |
| fl. number : | 01.003 |
| molar refractivity : | 43.67 ± 0.4 cm3 |
| parachor : | 349.0 ± 6.0 cm3 |
| index of refraction : | 1.483 ± 0.03 |
| surface tension : | 27.0 ± 5.0 dyne/cm |
| density : | 0.88 ± 0.1 g/cm3 |
| polarizability : | 17.34 ± 0.5 10-24cm3 |
| xlogp : | 4.20 |
| molecular weight : | 136.2340400 |
| formula : | C10 H16 |
| BioActivity Analysis : | 107522 |
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| fda reg : | 172.515 175.300 175.320 |
h. number : | 2902.19.0000 |
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| organoleptics : | |
| odor type : | herbal |
| odor strength : | high , recommend smelling in a 10.00 % solution or less |
odor description : at 10.00 % in dipropylene glycol. | dry woody resinous pine hay green |
| substantivity : | 4 Hour(s) |
| properties : | |
| appearence : | colorless clear liquid |
| assay : | 96.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.86700 - 0.87100 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.214 to 7.248
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| specific gravity : | 0.86400 - 0.87200 @ 20.00 °C.
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| pounds per gallon - calc. : | 7.198 to 7.264
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| refractive index : | 1.47700 - 1.48100 @ 20.00 °C.
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| boiling point : | 164.00 - 165.00 °C. @ 760.00 mm Hg
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| logp : | 4.37 |
| safety : | |
| most important hazard(s) : |
Xn - Harmful. |
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| Oral Toxicity(LD50) : |
Oral-Rat 4700.00 mg/kg
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | 95.00 °F. TCC ( 35.00 °C. )
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| recommendation for beta-pinene usage levels up to : |
| | 12.0000 % in the fragrance concentrate.
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| recommendation for beta-pinene usage levels up to : |
| | 100.0000 ppm in the flavor.
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| safety links : | |
| (EINECS) number : | 204-872-5 |
| chemidplus : | 000127913 |
| epa-srs : | 127-91-3 |
| dtp/nci : | 59190 |
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| other : | |
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| references : | |
| jecfa number : | 1330 |
| fl. number : | 01.003 |
| pubchem : | 173469 |
| NIST Chemistry WebBook : | 583578559 |
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