Articles:
| PubMed: | Density functional theory studies on the inclusion complexes of cyclic decapeptide with 1-phenyl-1-propanol enantiomers. |
benzenemethanol, a-ethyl-, (aS)-
Notes:
None found
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| CAS Number: | 613-87-6 |  3D/inchi
|
| Nikkaji Web: | J63.406I | |
| Beilstein Number: | 2041556 | |
| MDL: | MFCD00066207 | |
| XlogP3: | 1.90 (est) | |
| Molecular Weight: | 136.19384000 | |
| Formula: | C9 H12 O | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: flavor and fragrance agents
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
| Google Scholar: | Search |
| Google Books: | Search |
| Google Scholar: with word "volatile" | Search |
| Google Scholar: with word "flavor" | Search |
| Google Scholar: with word "odor" | Search |
| Perfumer and Flavorist: | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
Physical Properties:
| Appearance: | colorless to pale yellow clear liqudi (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.99200 @ 25.00 °C. |
| Refractive Index: | 1.51800 to 1.52200 @ 20.00 °C. |
| Optical Rotation: | -49.0 to -45.0 |
| Boiling Point: | 219.00 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 0.071000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 194.00 °F. TCC ( 90.00 °C. ) |
| logP (o/w): | 1.919 (est) |
| Soluble in: | |
| alcohol | |
| water, 5677 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Strength: | medium |
| Odor Description: at 100.00 %. | floral |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| BOC Sciences |
| For experimental / research use only. |
| (S)-1-phenyl-1-propanol ≥98%, ≥95%e.e. |
| EMD Millipore |
| For experimental / research use only. |
| (S)-(-)-1-Phenyl-1-propanol |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| (S)-(-)-1-Phenyl-1-propanol |
| Sigma-Aldrich: Aldrich |
| For experimental / research use only. |
| (S)-(-)-1-Phenyl-1-propanol 99% |
| TCI AMERICA |
| For experimental / research use only. |
| (S)-(-)-1-Phenyl-1-propanol >98.0%(GC) |
Safety Information:
| Preferred SDS: View | |
| 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:
| Category: | flavor and fragrance agents | ||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
Safety References:
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 2734864 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 3 |
| (1S)-1-phenylpropan-1-ol |
References:
| (1S)-1-phenylpropan-1-ol | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 2734864 |
| Pubchem (sid): | 30092633 |
Other Information:
| (IUPAC): | Atomic Weights of the Elements 2011 (pdf) |
| Videos: | The Periodic Table of Videos |
| tgsc: | Atomic Weights use for this web site |
| (IUPAC): | Periodic Table of the Elements |
| CHEMBL: | View |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 2906.29.6000 |
| ChemSpider: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| benzenemethanol, a-ethyl-, (aS)- | |
| (S)-(-)-a- | ethylbenzyl alcohol |
| (S)- | phenyl-1-propanol |
| (S)-(-)-1- | phenyl-1-propanol |
| (S)-1- | phenyl-1-propanol |
| (S)-1- | phenyl-propan-1-ol |
| (1S)-1- | phenylpropan-1-ol |