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| IUPAC name : | cyclohexanecarboxylic acid |
| InChI : | InChI=1/C7H12O2/c8-7(9)6-4-2-1-3-5-6/h6H,1-5H2,(H,8,9) |
| InChIKey : | NZNMSOFKMUBTKW-UHFFFAOYAH |
| SMILES : | C1CCC(CC1)C(=O)O |
| (EINECS) number : | 202-711-3 |
| cas number : | 98-89-5 |
| beilstein number : | 0970529 |
| fema number : | 3531 |
| coe number : | 11911 |
| jecfa number : | 961 |
| fl. number : | 08.060 |
| molar refractivity : | 33.77 ± 0.3 cm3 |
| parachor : | 300.9 ± 6.0 cm3 |
| index of refraction : | 1.480 ± 0.02 |
| surface tension : | 41.2 ± 3.0 dyne/cm |
| density : | 1.079 ± 0.06 g/cm3 |
| polarizability : | 13.39 ± 0.5 10-24cm3 |
| xlogp : | 1.80 |
| molecular weight : | 128.1689800 |
| formula : | C7 H12 O2 |
| BioActivity Analysis : | 67359 |
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| fda reg : | unspecified |
h. number : | unspecified |
| organoleptics : | |
| odor type : | fruity |
odor description :
| fruity acidic metallic cheese tropical |
| taste description³ : | at 5.00 ppm.
Fruity, woody, berry-like with green dirty nuances |
| properties : | |
| appearence : | white crystalline solid |
| assay : | 98.00 - 100.00 %
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| Food Chemicals Codex Listed : | No |
| melting point : | 30.00 - 32.00 °C. @ 760.00 mm Hg
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| boiling point : | 232.00 - 233.00 °C. @ 760.00 mm Hg
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| logp : | 1.96 |
| safety : | |
| Oral Toxicity(LD50) : |
Oral-Rat 3265.00 mg/kg
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| Dermal Toxicity(LD50) : |
Not determined
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| flash point ( Deg. F. ) : | > 230.00 °F. TCC ( > 110.00 °C. )
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| recommendation for cyclohexyl carboxylic acid usage levels up to : |
| | 0.0500 % in the fragrance concentrate.
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| recommendation for cyclohexyl carboxylic acid usage levels up to : |
| | 5.0000 ppm in the flavor.
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| safety links : | |
| (EINECS) number : | 202-711-3 |
| rtecs : | GU8370000 for 98-89-5 |
| chemidplus : | 000098895 |
| epa-srs : | 98-89-5 |
| dtp/nci : | 452 |
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| other : | |
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| references : | |
| jecfa number : | 961 |
| fl. number : | 08.060 |
| pubchem : | 150478 |
| NIST Chemistry WebBook : | 3591473726 |
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| reference : | Mosciano, Gerard P&F 17, No. 4, 33, (1992)³ |