| Name: | 2-[(3R,5S,8R)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-ol |
| CAS Number: | 489-86-1 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 207-702-8 |
| FDA UNII: | I7WP008A91 |
| Nikkaji Web: | J74.702E |
| Beilstein Number: | 2047993 |
| MDL: | MFCD00043336 |
| XlogP3-AA: | 3.10 (est) |
| Molecular Weight: | 222.37142000 |
| Formula: | C15 H26 O |
| NMR Predictor: | Predict (works with chrome, Edge or firefox) |
| Name: | 2-[(3S,5R,8S)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-ol |
| CAS Number: | 489-86-1 (SRS) |  3D/inchi
|
| FDA UNII: | Search |
| Nikkaji Web: | J252.480E |
| XlogP3-AA: | 3.10 (est) |
| Molecular Weight: | 222.37142000 |
| Formula: | C15 H26 O |
| BioActivity Summary: | listing |
| NMR Predictor: | Predict (works with chrome, Edge or firefox) |
Category:fragrance agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Physical Properties:
| Appearance: | white crystals (est) |
| Assay: | 97.00 to 100.00
|
| Food Chemicals Codex Listed: | No |
| Melting Point: | 91.00 to 93.00 °C. @ 760.00 mm Hg
|
| Boiling Point: | 309.00 to 310.00 °C. @ 760.00 mm Hg
|
| Vapor Pressure: | 0.000054 mmHg @ 25.00 °C. (est) |
| Flash Point: | 236.00 °F. TCC ( 113.33 °C. )
|
| logP (o/w): | 4.782 (est) |
| Shelf Life: | 12.00 month(s) or longer if stored properly. |
| Storage: | refrigerate in tightly sealed containers. |
| Soluble in: |
| | alcohol | | | water, 3.61 mg/L @ 25 °C (est) |
| Insoluble in: |
| | water |
Organoleptic Properties:
| Odor Type: woody |
| guaiacwood rose tea rose woody |
Odor Description:at 100.00 %. mild guaiacwood tea rose
Luebke, William tgsc, (1987) |
| Odor sample from: Fritzsche Dodge & Olcott, Inc. |
| Odor and/or flavor descriptions from others (if found). |
Cosmetic Information:
Suppliers:
Safety Information:
| Preferred SDS: View |
| European information : |
| Most important hazard(s): | | None - None found. |
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
|
| |
| Hazards identification |
| |
| Classification of the substance or mixture |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) |
| None found. |
| GHS Label elements, including precautionary statements |
| |
| Pictogram | |
| |
| Hazard statement(s) |
| None found. |
| Precautionary statement(s) |
| None found. |
| Oral/Parenteral Toxicity: |
|
Not determined
|
| Dermal Toxicity: |
|
Not determined
|
| Inhalation Toxicity: |
|
Not determined
|
Safety in Use Information:
Safety References:
| EPI System: View |
| AIDS Citations:Search |
| Cancer Citations:Search |
| Toxicology Citations:Search |
| EPA Substance Registry Services (TSCA):489-86-1 |
| EPA ACToR:Toxicology Data |
| EPA Substance Registry Services (SRS):Registry |
| Laboratory Chemical Safety Summary :72607 |
| National Institute of Allergy and Infectious Diseases:Data |
| WGK Germany:3 |
| 2-[(3R,5S,8R)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-ol |
| Chemidplus:0000489861 |
| 2-[(3S,5R,8S)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-ol |
References:
| | 2-[(3R,5S,8R)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-ol |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 489-86-1 |
| Pubchem (cid): | 72607 |
| Pubchem (sid): | 135030157 |
| Flavornet: | 489-86-1 |
| Pherobase: | View |
| | 2-[(3S,5R,8S)-3,8-dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-ol |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 489-86-1 |
| Pubchem (cid): | 227829 |
| Pubchem (sid): | 82678 |
Other Information:
Potential Blenders and core components note
Potential Uses:
Occurrence (nature, food, other): note
Synonyms:
| 5- | azulenemethanol, 1,2,3,4,5,6,7,8-octahydro-a,a,3,8-tetramethyl-, (3S,5R,8S)- | | 5- | azulenemethanol, 1,2,3,4,5,6,7,8-octahydro-a,a,3,8-tetramethyl-, [3S-(3a,5a,8a)]- | | | champaca camphor | | | champacol | | 2-[(3R,5S,8R)-3,8- | dimethyl-1,2,3,4,5,6,7,8-octahydroazulen-5-yl]propan-2-ol | | | guai-1(5)-en-11-ol | | | guaiac alcohol | | (-)- | guaiol | | | octahydro-3,8-dimethyl azulen-5-yl propan-2-ol | | 2-((3S,8S)-1,2,3,4,5,6,7,8- | octahydro-3,8-dimethyl azulen-5-yl) propan-2-ol | | 2-((3S,8S)-1,2,3,4,5,6,7,8- | octahydro-3,8-dimethylazulen-5-yl)propan-2-ol | | (3S-(3alpha, 5alpha,8alpha))- 1,2,3,4,5,6,7,8- | octahydro-alpha,alpha,3,8-tetramethyl-5-azulenemethanol |
Articles:
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