2-dimethylamino-6-fluorobenzonitrile structure
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Common Name | 2-dimethylamino-6-fluorobenzonitrile | ||
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CAS Number | 96994-73-9 | Molecular Weight | 164.18000 | |
Density | 1.13g/cm3 | Boiling Point | 65-70°C 0,5mm | |
Molecular Formula | C9H9FN2 | Melting Point | N/A | |
MSDS | N/A | Flash Point | 131-135°C/5mm |
Name | 2-dimethylamino-6-fluorobenzonitrile |
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Synonym | More Synonyms |
Density | 1.13g/cm3 |
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Boiling Point | 65-70°C 0,5mm |
Molecular Formula | C9H9FN2 |
Molecular Weight | 164.18000 |
Flash Point | 131-135°C/5mm |
Exact Mass | 164.07500 |
PSA | 27.03000 |
LogP | 1.76338 |
Index of Refraction | 1.552 |
Synonym: Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
Risk Phrases: 20/21/22 36/37/38 Section 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW
Harmful by inhalation, in contact with skin and if swallowed. Irritating to eyes, respiratory system and skin. Potential Health Effects Eye: May cause eye irritation. Skin: May cause skin irritation. Harmful if absorbed through the skin. Ingestion: Harmful if swallowed. May cause irritation of the digestive tract. Inhalation: Harmful if inhaled. May cause respiratory tract irritation. 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. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid. Notes to Physician: 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: Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable 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# 96994-73-9: 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: Liquid Color: yellow Odor: Not available. pH: Not available. Vapor Pressure: Not available. Viscosity: Not available. Boiling Point: 94 - 96 deg C @0.6mmHg Freezing/Melting Point: Not available. 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: C9H9FN2 Molecular Weight: 164 Section 10 - STABILITY AND REACTIVITY Chemical Stability: Not available. Conditions to Avoid: Incompatible materials. Incompatibilities with Other Materials: Strong oxidizing agents. Hazardous Decomposition Products: Nitrogen oxides, carbon monoxide, carbon dioxide, fluorine, hydrogen fluoride gas. Hazardous Polymerization: Has not been reported Section 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 96994-73-9 unlisted. LD50/LC50: Not available. Carcinogenicity: 2-(Dimethylamino)-6-fluorobenzonitrile - 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 Shipping Name: NITRILES, LIQUID, TOXIC, N.O.S.* Hazard Class: 6.1 UN Number: 3276 Packing Group: III IMO Shipping Name: NITRILES, TOXIC, N.O.S. Hazard Class: 6.1 UN Number: 3276 Packing Group: III RID/ADR Shipping Name: NITRILES, TOXIC, N.O.S. Hazard Class: 6.1 UN Number: 3276 Packing group: III Section 15 - REGULATORY INFORMATION European/International Regulations European Labeling in Accordance with EC Directives Hazard Symbols: XN Risk Phrases: R 20/21/22 Harmful by inhalation, in contact with skin and if swallowed. R 36/37/38 Irritating to eyes, respiratory system and skin. Safety Phrases: S 26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36/37/39 Wear suitable protective clothing, gloves and eye/face protection. WGK (Water Danger/Protection) CAS# 96994-73-9: No information available. Canada None of the chemicals in this product are listed on the DSL/NDSL list. CAS# 96994-73-9 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 96994-73-9 is not listed on the TSCA inventory. It is for research and development use only. SECTION 16 - ADDITIONAL INFORMATION N/A |
Hazard Codes | Xn:Harmful; |
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Risk Phrases | R20/21/22;R36/38 |
Safety Phrases | S23-S36/37/39 |
RIDADR | 3276 |
Packaging Group | III |
Hazard Class | 6.1 |
HS Code | 2926909090 |
~63% 2-dimethylamino... CAS#:96994-73-9 |
Literature: Chao, Bo; Tong, Xian-Kun; Tang, Wei; Li, De-Wen; He, Pei-Lan; Garcia, Jean-Michel; Zeng, Li-Min; Gao, An-Hui; Yang, Li; Li, Jia; Nan, Fa-Jun; Jacobs, Michael; Altmeyer, Ralf; Zuo, Jian-Ping; Hu, You-Hong Journal of Medicinal Chemistry, 2012 , vol. 55, # 7 p. 3135 - 3143 |
~83% 2-dimethylamino... CAS#:96994-73-9 |
Literature: Gupton, John T.; Wysong, Ernest; Norman, Bryan; Hertel, George; Idoux, John P. Synthetic Communications, 1985 , vol. 15, p. 43 - 52 |
~% 2-dimethylamino... CAS#:96994-73-9 |
Literature: Journal of Medicinal Chemistry, , vol. 47, # 8 p. 2075 - 2088 |
HS Code | 2926909090 |
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Summary | HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0% |
MFCD00052221 |
2-(dimethylamino)-6-fluorobenzonitrile |