(1S,2S,3R,5S)-(+)-pinane diol
bicyclo[3.1.1]heptane-2,3-diol, 2,6,6-trimethyl-, (1S,2S,3R,5S)-
Identification
| Name | (1S,2S,3R,5S)-(+)-pinane diol |
| IUPAC | (1S,2S,3R,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane-2,3-diol |
| CAS Number | 18680-27-8 |
| FDA UNII | Y6ZCV4AVRA |
| Molecular Formula | C10 H18 O2 |
| Molecular Weight | 170.25186000 |
| MDL Number | MFCD00077851 |
| Nikkaji Number | J551.231J |
| Beilstein | 1853591 |
Regulatory
Physical Properties
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Boiling Point | 263.74 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure | 0.001000 mmHg @ 25.00 °C. (est) |
| Flash Point | > 230.00 °F. TCC ( > 110.00 °C. ) |
| logP (o/w) | 1.582 (est) |
| Soluble in | water, 2085 mg/L @ 25 °C (est) |
No sensory data available
Safety Information
| Preferred SDS | View |
| Oral/Parenteral Toxicity | Not determined |
| Dermal Toxicity | Not determined |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | natural substances and extractives |
| Recommendation for (1S,2S,3R,5S)-(+)-pinane diol usage levels up to | not for fragrance use. |
| Recommendation for (1S,2S,3R,5S)-(+)-pinane diol flavor usage levels up to | not for flavor use. |
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Potential Uses
Natural Occurrence
Synonyms
bicyclo[3.1.1]heptane-2,3-diol, 2,6,6-trimethyl-, (1S,2S,3R,5S)-
(1S,2S,3R,5S)-(+)-
pinanediol
(1S,2S,3R,5S)-(+)-2,3-
pinanediol
(1S,2S,3R,5S)-2,3-
pinanediol
(1S,2S,3R,5S)-2,6,6-
trimethylbicyclo[3.1.1]heptan-2,3-diol
(1S,2S,3R,5S)-(+)-2,6,6-
trimethylbicyclo[3.1.1]heptane-2,3-diol
(1S,2S,3R,5S)-2,6,6-
trimethylbicyclo[3.1.1]heptane-2,3-diol
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