Articles:
heptane, 2,2,4,6,6-pentamethyl-
Notes:
None found
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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): 13475-82-6 Heptane,2,2,4,6,6-pentamethyl- 95%
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TCI AMERICA Moving Your Chemistry Forward We continuously strive to advance our technology. With East & West Coast distribution centers, count on TCI to deliver products quickly and reliably. Over 30,000 Reagents available today in benchtop to bulk quantities. We also offer custom synthesis solutions. Sign up for a TCI account today for fast and free shipping! Tokyo Chemical Industry Co., Ltd. (TCI) is a leading worldwide manufacturer of specialty organic chemicals founded in 1946. TCI provides organic laboratory chemicals as well as pharmaceutical, cosmetic and functional materials. More than 70 years of synthesis experience and multi-purpose plants enable TCI to offer more than 30,000 products as well as custom synthesis. US Email: Sales Email: Technical Support Voice: 1-800-423-8616 Fax: 1- 888-520-1075 Facebook Twitter Instagram Linkedin Product(s): P0047 2,2,4,6,6-Pentamethylheptane >98.0%(GC)
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| CAS Number: | 13475-82-6 |  3D/inchi
|
| Other(deleted CASRN): | 132702-84-2 | |
| ECHA EINECS - REACH Pre-Reg: | 236-757-0 | |
| FDA UNII: | A8289P68Y2 | |
| Nikkaji Web: | J133.533B | |
| Beilstein Number: | 1731750 | |
| MDL: | MFCD00026334 | |
| XlogP3-AA: | 5.60 (est) | |
| Molecular Weight: | 170.33922000 | |
| Formula: | C12 H26 | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: cosmetic 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 |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
Physical Properties:
| Appearance: | colorless clear liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 177.00 to 178.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 1.422000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 137.00 °F. TCC ( 58.40 °C. ) (est) |
| logP (o/w): | 6.156 (est) |
| Soluble in: | |
| alcohol | |
| water, 0.1508 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| CosIng: | cosmetic data |
| Cosmetic Uses: |
perfuming agents skin conditioning - emollient solvents |
Suppliers:
| BOC Sciences |
| For experimental / research use only. |
| Heptane,2,2,4,6,6-pentamethyl- 95% |
| Sigma-Aldrich |
| For experimental / research use only. |
| IsoDodecane puriss., ≥99.0% (GC) |
| TCI AMERICA |
| For experimental / research use only. |
| 2,2,4,6,6-Pentamethylheptane >98.0%(GC) |
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: | |
| Not determined | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | cosmetic agents | ||
| Recommendation for 2,2,4,6,6-pentamethyl heptane usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for 2,2,4,6,6-pentamethyl heptane flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 13475-82-6 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 26058 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 3 |
| 2,2,4,6,6-pentamethylheptane | |
| Chemidplus: | 0013475826 |
References:
| 2,2,4,6,6-pentamethylheptane | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 13475-82-6 |
| Pubchem (cid): | 26058 |
| Pubchem (sid): | 134991162 |
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 |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 2901.10.5000 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| beef Search PMC Picture |
Synonyms:
| heptane, 2,2,4,6,6-pentamethyl- | |
| 2,2,4,6,6- | pentamethylheptane |