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2-cyanobutane
Notes:
None found
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| CAS Number: | 18936-17-9 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 242-687-1 | |
| FDA UNII: | R5Y900M14U | |
| Nikkaji Web: | J77.618A | |
| MDL: | MFCD00001877 | |
| XlogP3: | 1.10 (est) | |
| Molecular Weight: | 83.13373000 | |
| Formula: | C5 H9 N | |
| BioActivity Summary: | listing | |
| NMR Predictor: | Predict (works with chrome, Edge or firefox) | |
Category: natural substances and extractives
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 to pale yellow clear liquid (est) |
| Assay: | 95.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 125.00 °C. @ 760.00 mm Hg |
| Boiling Point: | 127.00 to 128.00 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 11.198000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 76.00 °F. TCC ( 24.40 °C. ) (est) |
| logP (o/w): | 1.050 |
| Soluble in: | |
| alcohol | |
| water, 8889 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| BOC Sciences |
| For experimental / research use only. |
| 2-Methylbutyronitrile 95% |
| Lonza Group |
| 2-Methylbutyronitrile BN,2-Me 80 |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| 2-Methylbutyronitrile |
| Sigma-Aldrich: Aldrich |
| For experimental / research use only. |
| 2-Methylbutyronitrile Lonza quality, ≥80.0% (GC) |
| TCI AMERICA |
| For experimental / research use only. |
| 2-Methylbutyronitrile >95.0%(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: | |
|
oral-mouse LD50 23839 mg/kg Nippon Eiseigaku Zasshi. Japanese Journal of Hygiene. Vol. 39, Pg. 423, 1984. | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | natural substances and extractives | ||
| Recommendation for 2-methyl butyronitrile usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for 2-methyl butyronitrile 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 : | 29339 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 3 |
| 2-methylbutanenitrile | |
| Chemidplus: | 0018936179 |
| RTECS: | EU0530000 for cas# 18936-17-9 |
References:
| 2-methylbutanenitrile | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 29339 |
| Pubchem (sid): | 134992074 |
| 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 |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 2926.90.5050 |
| Typical G.C. | |
| 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
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Synonyms:
| 2- | cyanobutane |
| 2- | methyl butane nitrile |
| 2- | methyl butanone cyanohydrin |
| alpha- | methyl butyronitrile |
| 2- | methylbutanenitrile |
| 2- | methylbutyronitrile |