Articles:
(R)-3,7-dimethyl-6-octenal
Notes:
Constit. of citronella oil. Also in citrus, lavender, eucalyptus oils and others. Flavouring agent
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BOC Sciences Best of Chemicals Supplier Quality supplier of research chemicals and biochemicals including inhibitors, building blocks, GMP Products, impurities and metabolites, APIs for Veterinary, Natural Compounds, ADCs, Stem Cell Molecule and chiral compounds. BOC Sciences provides a wide range of services to support the pharmaceutical industry through all stages of drug discovery including Custom Synthesis of those chemicals that are not in stock, Isotope Labeling Service, Chiral Synthesis and Resolution, Bioconjugation, PEGylation services, analytical services. BOC Sciences is a brand of BOCSCI Inc. We leverage our wide spectrum of business in the fields of development, manufacturing, marketing, and distribution to help you make best-informed decisions tailored to your evolving needs for premium chemicals. Our complete suite of CRO services spans the entire molecule development pipeline including contract research for target identification, building blocks, compound synthesis, biochemical and cellular analysis, preclinical animal tests, and clinical studies. Email: Marketing US Email: Marketing Email: Sales US Email: Sales Voice: 1-631-485-4226 Fax: 1-631-614-7828 US Voice: 1-631-485-4226 US Fax: 1-631-614-7828 Europe 44-203-286-1088 Facebook Twitter Linkedin Blog Get the App! Product(s): 2385-77-5 6-Octenal,3,7-dimethyl-, (3R)- >95.0%(GC)
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| CAS Number: | 2385-77-5 |  3D/inchi
|
| Other(deleted CASRN): | 951036-03-6 | |
| ECHA EINECS - REACH Pre-Reg: | 219-194-5 | |
| Nikkaji Web: | J43.580E | |
| Beilstein Number: | 1720791 | |
| MDL: | MFCD00067089 | |
| XlogP3-AA: | 3.00 (est) | |
| Molecular Weight: | 154.25266000 | |
| Formula: | C10 H18 O | |
| BioActivity Summary: | listing | |
| 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 liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Specific Gravity: | 0.85100 @ 25.00 °C. |
| Refractive Index: | 1.44800 @ 20.00 °C. |
| Boiling Point: | 207.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 0.215000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 185.00 °F. TCC ( 85.00 °C. ) |
| logP (o/w): | 3.830 |
| Soluble in: | |
| alcohol | |
| water, 38.94 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Type: herbal | |
| Odor Strength: | medium , recommend smelling in a 10.00 % solution or less |
| fresh herbal citrus | |
| Odor Description: at 100.00 %. | fresh herbal citrus |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| BOC Sciences |
| For experimental / research use only. |
| 6-Octenal,3,7-dimethyl-, (3R)- >95.0%(GC) |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| (R)-(+)-Citronellal |
| Sigma-Aldrich: Aldrich |
| For experimental / research use only. |
| (R)-(+)-Citronellal technical grade, 90% |
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 Substance Registry Services (TSCA): | 2385-77-5 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 75427 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 3 |
| (3R)-3,7-dimethyloct-6-enal | |
| Chemidplus: | 0002385775 |
References:
| Leffingwell: | Chirality or Article |
| (3R)-3,7-dimethyloct-6-enal | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 2385-77-5 |
| Pubchem (cid): | 75427 |
| Pubchem (sid): | 135031062 |
| 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): | C09848 |
| HMDB (The Human Metabolome Database): | HMDB35820 |
| FooDB: | FDB014582 |
| Export Tariff Code: | 2912.19.2000 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Wikipedia: | View |
Potential Blenders and core components note
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| basil clove basil Search Trop Picture | |
| citronella oil Search PMC Picture | |
| eucalyptus oil Search Trop Picture | |
| lavender oil Search Trop Picture | |
| lemon balm shoot Search Trop Picture |
Synonyms:
| (3R)-(+)- | citronellal |
| (R)-3,7- | dimethyl oct-6-enal |
| (3R)-3,7- | dimethyl-6-octenal |
| (R)-3,7- | dimethyl-6-octenal |
| (3R)-3,7- | dimethyloct-6-enal |
| (R)-3,7- | dimethyloct-6-enal |
| 6- | octenal, 3,7-dimethyl-, (3R)- |
| 6- | octenal, 3,7-dimethyl-, (R)- |