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trans-p-propenylguaiacol
Notes:
None found
| CAS Number: | 5932-68-3 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 227-678-2 | |
| FDA UNII: | 28FSR1NAY4 | |
| Nikkaji Web: | J53.761F | |
| Beilstein Number: | 2046156 | |
| MDL: | MFCD00009285 | |
| XlogP3: | 2.60 (est) | |
| Molecular Weight: | 164.20404000 | |
| Formula: | C10 H12 O2 | |
| BioActivity Summary: | listing | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: 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: | colorlss to pale yellow clear viscous liquid to solid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Melting Point: | 32.00 to 34.00 °C. @ 760.00 mm Hg |
| Boiling Point: | 266.00 to 268.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 0.005000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 253.00 °F. TCC ( 122.78 °C. ) |
| logP (o/w): | 2.451 (est) |
| Soluble in: | |
| alcohol | |
| water, 165.9 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Type: spicy | |
| sweet spicy carnation phenolic floral | |
| Odor Description: at 100.00 %. | sweet spicy carnation phenolic floral Luebke, William tgsc, (1985) |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
perfuming agents |
Suppliers:
| Sigma-Aldrich |
| For experimental / research use only. |
| Isoeugenol, predominantly trans analytical standard |
Safety Information:
| 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: | |
|
intraperitoneal-mouse LD50 540 mg/kg Luebke, William tgsc, (1985) intraperitoneal-mouse LD50 540 mg/kg Food and Cosmetics Toxicology. Vol. 13, Pg. 815, 1975. | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | fragrance agents | ||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| IFRA Critical Effect: | Sensitization | ||
| limits in the finished product for - "leave on the skin contact": | |||
| 0.0200 % Restriction. | |||
| limits in the finished product for - "wash off the skin contact": | |||
| 0.0200 % Restriction. | |||
| limits in the finished product for - "no skin contact": | |||
| 0.2000 % Restriction. | |||
| Recommendation for (E)-isoeugenol usage levels up to: | |||
| 2.0000 % in the fragrance concentrate. | |||
| Recommendation for (E)-isoeugenol flavor usage levels up to: | |||
| not for flavor use. | |||
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 : | 853433 |
| National Institute of Allergy and Infectious Diseases: | Data |
| SCCNFP: | opinion |
| WGK Germany: | 2 |
| 2-methoxy-4-[(E)-prop-1-enyl]phenol | |
| Chemidplus: | 0005932683 |
References:
| 2-methoxy-4-[(E)-prop-1-enyl]phenol | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 853433 |
| Pubchem (sid): | 134970634 |
| Flavornet: | 5932-68-3 |
| Pherobase: | View |
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 |
| CHEBI: | View |
| CHEMBL: | View |
| KEGG (GenomeNet): | C10469 |
| HMDB (The Human Metabolome Database): | HMDB05802 |
| FooDB: | FDB012403 |
| YMDB (Yeast Metabolome Database): | YMDB01677 |
| Export Tariff Code: | 2909.50.4010 |
| Typical G.C. | |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Wikipedia: | View |
Potential Blenders and core components note
Potential Uses:
| carnation | FR | |
| clove | FR | |
| spice | FR |
Occurrence (nature, food, other): note
| cananga oil china @ 1.54% Data GC Search Trop Picture | |
| clove bud Search Trop Picture | |
| clove fruit Search Trop Picture | |
| jasmin absolute china @ 28.94% Data GC Search Trop Picture | |
| laurel leaf oil turkey @ 0.20% Data GC Search Trop Picture | |
| mace oil CO2 extract @ 0.10% Data GC Search Trop Picture | |
| nutmeg extract CO2 west indian @ trace% Data GC Search Trop Picture | |
| nutmeg flower oil @ 0.56% Data GC Search Trop Picture | |
| nutmeg leaf oil @ 0.00-0.40% Data GC Search Trop Picture | |
| nutmeg oil Search Trop Picture | |
| osmanthus absolute @ 0.02% Data GC Search Trop Picture |
Synonyms:
| (E)-iso | eugenol |
| trans-iso | eugenol |
| iso | eugenol E |
| iso | eugenol trans-form |
| iso | eugenol, (E)-isomer |
| 2- | methoxy-4-((E)-propenyl)-phenol |
| trans-2- | methoxy-4-(1-propenyl)phenol |
| (E)-2- | methoxy-4-(prop-1-en-1-yl)phenol |
| (E)-2- | methoxy-4-(prop-1-enyl) phenol |
| trans-2- | methoxy-4-(prop-1-enyl) phenol |
| (E)-2- | methoxy-4-(prop-1-enyl)phenol |
| 2- | methoxy-4-[(1E)-1-propen-1-yl]phenol |
| 2- | methoxy-4-[(1E)-prop-1-en-1-yl]phenol |
| 2- | methoxy-4-[(E)-prop-1-enyl]phenol |
| (E)-2- | methoxy-4-propenyl phenol |
| trans-2- | methoxy-4-propenyl phenol |
| trans-2- | methoxy-4-propenylphenol |
| phenol, 2-methoxy-4-(1-propenyl)-, (E)- | |
| (E)-p- | propenyl guaiacol |
| (E)-para- | propenyl guaiacol |
| trans-p- | propenyl guaiacol |
| trans-para- | propenyl guaiacol |
| (E)-para- | propenylguaiacol |
| trans-p- | propenylguaiacol |
| trans-para- | propenylguaiacol |
| (E)-p- | propenylquaiacol |
| trans-p- | propenylquaiacol |