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| IUPAC name : | 4,7-dimethyl-1-propan-2-yl-1,2,4a,5,8,8a-hexahydronaphthalene |
| InChI : | InChI=1/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5-6,10,13-15H,7-9H2,1-4H3 |
| InChIKey : | USDOQCCMRDNVAH-UHFFFAOYAN |
| SMILES : | CC1=CCC2C(C1)C(CC=C2C)C(C)C |
| (EINECS) number : | 249-580-9 |
| cas number : | 29350-73-0 |
| coe number : | 10982 |
| jecfa number : | 1346 |
| fl. number : | 01.021 |
| molar refractivity : | 67.05 ± 0.3 cm3 |
| parachor : | 547.2 ± 6.0 cm3 |
| index of refraction : | 1.462 ± 0.02 |
| surface tension : | 25.3 ± 3.0 dyne/cm |
| density : | 0.846 ± 0.06 g/cm3 |
| polarizability : | 26.58 ± 0.5 10-24cm3 |
| xlogp : | 5.60 |
| molecular weight : | 206.3669400 |
| formula : | C15 H26 |
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| IUPAC name : | (1S,4S,4aS,6R,8aR)-1,6-dimethyl-4-propan-2-yl-1,2,3,4,4a,5,6,8a-octahydronaphthalene |
| InChI : | InChI=1/C15H26/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7,10-15H,6,8-9H2,1-4H3/t11-,12-,13-,14-,15-/m0/s1 |
| InChIKey : | HNTISMRTGMVWGH-YTFOTSKYBE |
| SMILES : | C[C@H]1CC[C@H]([C@H]2[C@H]1C=C[C@@H](C2)C)C(C)C |
| cas number : | 29350-73-0 |
| molar refractivity : | 67.05 ± 0.3 cm3 |
| parachor : | 547.2 ± 6.0 cm3 |
| index of refraction : | 1.462 ± 0.02 |
| surface tension : | 25.3 ± 3.0 dyne/cm |
| density : | 0.846 ± 0.06 g/cm3 |
| polarizability : | 26.58 ± 0.5 10-24cm3 |
| xlogp : | 5.60 |
| molecular weight : | 206.3669400 |
| formula : | C15 H26 |
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| fda reg : | 172.515 |
h. number : | unspecified |
| organoleptics : | |
| odor type : | woody |
| odor strength : | medium |
odor description :
at 100.00 %. | fresh woody longifolone |
| substantivity : | 24 Hour(s) |
| properties : | |
| appearence : | colorless to yellow clear liquid |
| assay : | 65.00 - 100.00 % sum of isomers
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| Food Chemicals Codex Listed : | No |
| specific gravity : | 0.90800 - 0.92500 @ 25.00 °C.
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| pounds per gallon - calc. : | 7.555 to 7.697
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| refractive index : | 1.51000 - 1.52000 @ 20.00 °C.
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| boiling point : | 261.00 - 262.00 °C. @ 760.00 mm Hg
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| logp : | 6.80 |
| safety : | |
| Oral Toxicity(LD50) : |
Oral-Rat >5.00 gm/kg
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| Dermal Toxicity(LD50) : |
Skin-Rabbit >5.00 gm/kg
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| flash point ( Deg. F. ) : | > 212.00 °F. TCC ( > 100.00 °C. )
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| recommendation for cadinene usage levels up to : | | | 10.0000 % in the fragrance concentrate.
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| safety links : | |
| (EINECS) number : | 249-580-9 |
| chemidplus : | 29350-73-0 |
| epa-srs : | 29350-73-0 |
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| chemidplus : | 029350730 |
| epa-srs : | 29350-73-0 |
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| other : | |
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| references : | |
| pubchem : | 10426671 |
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| pubchem : | 176271 |
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| synonyms : |
| | cadinene | | (1S,4S,4aS,6S,8aS)- | decahydro-1,6-dimethyl-4-(1-methyl ethyl) naphthalene didehydro deriv. | | (1S-(1alpha,4alpha,4aalpha,6alpha,8abeta))- | decahydro-4-isopropyl-1,6-dimethyl naphthalene didehydro derivative | | (1S,4S,4aS,6R,8aS)-1,6- | dimethyl-4-propan-2-yl-1,2,3,4,4a,5,6,8a-octahydronaphthalene |
| soluble in : |
| | alcohol |
| insoluble in : |
| | water |
| (odor and/or flavor) used in : |
| | amyris | | | cade | | | cedarwood atlas | | | citronella | | | fixer | | | floral | | | juniper | | | lemongrass | | | medical | | | patchouli | | | sandalwood | | | sassafras | | | savin | | | woody | | | wormwood absinthium | | | ylang ylang cananga |
| natural occurrence in : |
| data page | artemisia vestita wall. flower oil @ 6.00% |
| data page | artemisia vestita wall. leaf oil @ 6.00% |
| camphor |
| cedarleaf |
| cedarwood |
| galbanum |
| juniperberry |
| lemongrass |
| data page | lemongrass oil egypt @ 0.59% |
| olibanum |
| patchouli |
| pepper |
| pinus pumilio |
| savin |
| data page | savin oil @ 0.10% |
| ylang ylang |
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