Articles:
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thiocyanic acid, ethyl ester
Notes:
None found
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| CAS Number: | 542-90-5 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 208-833-3 | |
| FDA UNII: | PF9AD5G86Z | |
| Nikkaji Web: | J1.602K | |
| Beilstein Number: | 1737620 | |
| MDL: | MFCD00001834 | |
| XlogP3-AA: | 1.30 (est) | |
| Molecular Weight: | 87.14485000 | |
| Formula: | C3 H5 N S | |
| BioActivity Summary: | listing | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: information only not used for fragrances or flavors
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 |
| Specific Gravity: | 1.01200 to 1.01400 @ 20.00 °C. |
| Pounds per Gallon - (est).: | 8.431 to 8.447 |
| Refractive Index: | 1.46200 to 1.46400 @ 20.00 °C. |
| Boiling Point: | 145.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 5.074000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 109.00 °F. TCC ( 42.80 °C. ) |
| logP (o/w): | 1.011 (est) |
| Soluble in: | |
| alcohol | |
| water, 1.155e+004 mg/L @ 25 °C (est) | |
Organoleptic Properties:
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| Indenta Group |
| Ethyl Thiocyanate |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| Ethyl thiocyanate |
| Sigma-Aldrich: Aldrich |
| For experimental / research use only. |
| Ethyl thiocyanate 98% |
| TCI AMERICA |
| For experimental / research use only. |
| Ethyl Thiocyanate >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: | |
|
oral-cat LDLo 10 mg/kg BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) GASTROINTESTINAL: OTHER CHANGES LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES Journal of Industrial Hygiene and Toxicology. Vol. 18, Pg. 310, 1936. intraperitoneal-mouse LD50 10 mg/kg BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD PERIPHERAL NERVE AND SENSATION: FLACCID PARALYSIS WITHOUT ANESTHESIA (USUALLY NEUROMUSCULAR BLOCKAGE) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION Japanese Journal of Pharmacology. Vol. 3, Pg. 99, 1954. intravenous-mouse LD50 18 mg/kg U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#02865 oral-rat LDLo 201 mg/kg LUNGS, THORAX, OR RESPIRATION: CYANOSIS LUNGS, THORAX, OR RESPIRATION: DYSPNEA BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Journal of Industrial Hygiene and Toxicology. Vol. 18, Pg. 310, 1936. | |
| Dermal Toxicity: | |
|
subcutaneous-mouse LD50 70 mg/kg PERIPHERAL NERVE AND SENSATION: FLACCID PARALYSIS WITHOUT ANESTHESIA (USUALLY NEUROMUSCULAR BLOCKAGE) LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES Japanese Journal of Pharmacology. Vol. 3, Pg. 99, 1954. subcutaneous-rabbit LDLo 15 mg/kg BEHAVIORAL: ATAXIA BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 150, Pg. 257, 1930. skin-rat LDLo 2512 mg/kg BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) Journal of Industrial Hygiene and Toxicology. Vol. 18, Pg. 310, 1936. subcutaneous-rat LDLo 40 mg/kg BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) LUNGS, THORAX, OR RESPIRATION: DYSPNEA LUNGS, THORAX, OR RESPIRATION: CYANOSIS Journal of Industrial Hygiene and Toxicology. Vol. 18, Pg. 310, 1936. | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | information only not used for fragrances or flavors | ||
| Recommendation for ethyl thiocyanate usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for ethyl thiocyanate 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): | 542-90-5 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 10968 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WGK Germany: | 3 |
| ethyl thiocyanate | |
| Chemidplus: | 0000542905 |
| EPA/NOAA CAMEO: | hazardous materials |
| RTECS: | XK9900000 for cas# 542-90-5 |
References:
| ethyl thiocyanate | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 10968 |
| Pubchem (sid): | 134976507 |
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 |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 2930.90.9190 |
| ChemSpider: | View |
| Wikipedia: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| None Found |
Occurrence (nature, food, other): note
| not found in nature |
Synonyms:
| ethane, thiocyanato- | |
| ethyl rhodanate | |
| ethyl rhodanide | |
| ( | ethyl thio) cyanate |
| ( | ethylthio)cyanate |
| ethylthiocyanate | |
| thiocyanatoethane | |
| thiocyanic acid ethyl ester | |
| thiocyanic acid, ethyl ester |