Name | Methyl 3-amino-5-phenylthiophene-2-carboxylate |
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Synonyms |
MFCD00068161
Methyl 3-amino-5-phenylthiophene-2-carboxylate 2-Thiophenecarboxylic acid, 3-amino-5-phenyl-, methyl ester Methyl 3-amino-5-phenyl-2-thiophenecarboxylate |
Density | 1.3±0.1 g/cm3 |
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Boiling Point | 442.5±45.0 °C at 760 mmHg |
Melting Point | 147 °C |
Molecular Formula | C12H11NO2S |
Molecular Weight | 233.286 |
Flash Point | 221.4±28.7 °C |
Exact Mass | 233.051056 |
PSA | 80.56000 |
LogP | 3.25 |
Vapour Pressure | 0.0±1.1 mmHg at 25°C |
Index of Refraction | 1.626 |
Synonym: Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
Risk Phrases: None Listed. Section 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW
Not available. Potential Health Effects Eye: May cause eye irritation. Skin: May cause skin irritation. May be harmful if absorbed through the skin. Ingestion: May cause irritation of the digestive tract. May be harmful if swallowed. Inhalation: May cause respiratory tract irritation. May be harmful if inhaled. Chronic: Not available. Section 4 - FIRST AID MEASURES Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid. Skin: Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Ingestion: Get medical aid. Wash mouth out with water. Inhalation: Remove from exposure and move to fresh air immediately. Notes to Physician: Treat symptomatically and supportively. Section 5 - FIRE FIGHTING MEASURES General Information: As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. Extinguishing Media: Use water spray, dry chemical, carbon dioxide, or chemical foam. Section 6 - ACCIDENTAL RELEASE MEASURES General Information: Use proper personal protective equipment as indicated in Section 8. Spills/Leaks: Vacuum or sweep up material and place into a suitable disposal container. Section 7 - HANDLING and STORAGE Handling: Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes. Storage: Store in a cool, dry place. Store in a tightly closed container. Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION Engineering Controls: Use adequate ventilation to keep airborne concentrations low. Exposure Limits CAS# 100063-22-7: Personal Protective Equipment Eyes: Not available. Skin: Wear appropriate protective gloves to prevent skin exposure. Clothing: Wear appropriate protective clothing to prevent skin exposure. Respirators: Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced. Section 9 - PHYSICAL AND CHEMICAL PROPERTIES Physical State: Solid Color: off-white Odor: Not available. pH: Not available. Vapor Pressure: Not available. Viscosity: Not available. Boiling Point: Not available. Freezing/Melting Point: 145 - 148 deg C Autoignition Temperature: Not available. Flash Point: Not available. Explosion Limits, lower: Not available. Explosion Limits, upper: Not available. Decomposition Temperature: Solubility in water: Specific Gravity/Density: Molecular Formula: C12H11NO2S Molecular Weight: 233 Section 10 - STABILITY AND REACTIVITY Chemical Stability: Not available. Conditions to Avoid: Incompatible materials. Incompatibilities with Other Materials: Strong oxidizing agents, acid chlorides. Hazardous Decomposition Products: Nitrogen oxides, carbon monoxide, oxides of sulfur, carbon dioxide. Hazardous Polymerization: Has not been reported Section 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 100063-22-7 unlisted. LD50/LC50: Not available. Carcinogenicity: Methyl 3-amino-5-phenylthiophene-2-carboxylate - Not listed by ACGIH, IARC, or NTP. Section 12 - ECOLOGICAL INFORMATION Section 13 - DISPOSAL CONSIDERATIONS Dispose of in a manner consistent with federal, state, and local regulations. Section 14 - TRANSPORT INFORMATION IATA No information available. IMO No information available. RID/ADR No information available. Section 15 - REGULATORY INFORMATION European/International Regulations European Labeling in Accordance with EC Directives Hazard Symbols: Not available. Risk Phrases: Safety Phrases: S 24/25 Avoid contact with skin and eyes. WGK (Water Danger/Protection) CAS# 100063-22-7: No information available. Canada None of the chemicals in this product are listed on the DSL/NDSL list. CAS# 100063-22-7 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 100063-22-7 is not listed on the TSCA inventory. It is for research and development use only. SECTION 16 - ADDITIONAL INFORMATION N/A |
Symbol |
GHS07 |
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Signal Word | Warning |
Hazard Statements | H302 |
Hazard Codes | Xi: Irritant; |
Risk Phrases | R36/37/38 |
Safety Phrases | S24/25 |
RIDADR | NONH for all modes of transport |
~50% 100063-22-7 |
Literature: LAILA NUTRACEUTICALS Patent: US2010/68178 A1, 2010 ; Location in patent: Page/Page column 14 ; |
~% 100063-22-7 |
Literature: Journal of Medicinal Chemistry, , vol. 49, # 24 p. 7095 - 7107 |
~% 100063-22-7 |
Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 11, # 1 p. 9 - 12 |
~% 100063-22-7 |
Literature: European Journal of Medicinal Chemistry, , vol. 76, p. 343 - 351 |
~% 100063-22-7 |
Literature: Bioorganic and Medicinal Chemistry Letters, , vol. 11, # 1 p. 9 - 12 |
~% 100063-22-7 |
Literature: European Journal of Medicinal Chemistry, , vol. 65, p. 223 - 231 |
Precursor 8 | |
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DownStream 9 | |