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| IUPAC name : | (6S)-1,7,7-trimethylbicyclo[2.2.1]heptan-6-ol |
| InChI : | InChI=1/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7?,8-,10u/m0/s1 |
| InChIKey : | DTGKSKDOIYIVQL-ZCUBBSJVBW |
| SMILES : | CC1(C2CCC1(C(C2)O)C)C |
| cas number : | 464-43-7 |
| (EINECS) number : | 207-352-6 |
| beilstein number : | 2038056 |
| molar refractivity : | 45.85 ± 0.3 cm3 |
| parachor : | 381.2 ± 4.0 cm3 |
| index of refraction : | 1.502 ± 0.02 |
| surface tension : | 36.2 ± 3.0 dyne/cm |
| density : | 0.992 ± 0.06 g/cm3 |
| polarizability : | 18.17 ± 0.5 10-24cm3 |
| XlogP : | 2.70 |
| XlogP3 : | 2.70 |
| molecular weight : | 154.2493200 (IUPAC) |
| formula : | C10 H18 O |
| NMR Predictor : | Predict |
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| export tariff code : | unspecified |
| fda reg : | unspecified |
Suppliers :
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| Nanjing : | (+)-borneol
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| Sigma-Aldrich-Aldrich : | (+)-Borneol
97% |
organoleptics :
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| odor type : | balsamic |
| odor strength : | medium , recommend smelling in a 10.00 % solution or less |
odor description : at 10.00 % in dipropylene glycol. | pine camphor earthy |
properties :
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| appearence : | white crystalline powder |
| assay : | 98.00 to 100.00 %
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| Food Chemicals Codex Listed : | No |
| melting point : | 207.00 to 208.00 °C. @ 760.00 mm Hg
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| boiling point : | 212.00 °C. @ 760.00 mm Hg
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| vapor pressure : | 0.03900 mm/Hg @ 25.00 °C. |
| flash point : | 150.00 °F. TCC ( 65.56 °C. )
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| logP (o/w) : | 2.85 |
safety :
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| most important hazard(s) : | Xn - Harmful. |
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R 22 - Harmful if swallowed. S 02 - Keep out of the reach of children. S 22 - Do not breath dust. S 36/37/39 - Wear suitable clothing, gloves and eye/face protection.
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| Oral Toxicity(LD50) : |
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Oral-Rat 2000.00 mg/kg 11th ed., Rahway, NJ 07065, Merck & Co., Inc. 1989Vol. 11, Pg. 204, 1989.
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| Dermal Toxicity(LD50) : |
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Not determined
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| Inhalation Toxicity(LC50) : |
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Not determined
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safety in use :
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| recommendation for dextro-borneol usage levels up to : |
| | 2.0000 % in the fragrance concentrate.
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safety references :
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| EPI System : | view |
| Chemical Carcinogenesis Research Information System : | Search |
| WISER : | UN 1312 |
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| WGK Germany : | 3 |
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| | (6S)-1,7,7-trimethylbicyclo[2.2.1]heptan-6-ol
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| (EINECS) number : | 207-352-6 |
| RTECS : | ED7060000 for 464-43-7 |
| chemidplus : | 000464437 |
| EPA Substance Registry Services : | 464-43-7 |
references :
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| | (6S)-1,7,7-trimethylbicyclo[2.2.1]heptan-6-ol
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| NIST Chemistry WebBook : | 464437 |
| pubchem : | 36883766 |
other :
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| VCF-Online: | VCF Volatile Compounds in Food |