2′-Nitroacetophenone
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2′-Nitroacetophenone
structure -
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CAS No:
577-59-3
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Formula:
C8H7NO3
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Chemical Name:
2′-Nitroacetophenone
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Synonyms:
Ethanone,1-(2-nitrophenyl)-;Acetophenone,2′-nitro-;1-(2-Nitrophenyl)ethanone;2′-Nitroacetophenone;o-Nitroacetophenone;Methyl 2-nitrophenyl ketone;2-Acetylnitrobenzene;NSC 3641;1-Acetyl-2-nitrobenzene;Methyl o-nitrophenyl ketone;2-Nitrophenylmethylketone;1-(2-Nitrophenyl)ethan-1-one
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CAS No:
Description
yellow-green liquid or crystals
O-nitroacetophenone is a clear yellow liquid. Insoluble in water. (NTP, 1992)
O-nitroacetophenone is a clear yellow liquid. Insoluble in water. (NTP, 1992)
2′-Nitroacetophenone Basic Attributes
165.15
165.15
1102322
209-414-8
52L53K4X3O
3641
DTXSID6025723
29147090
Characteristics
62.9
1.3
O-nitroacetophenone is a clear yellow liquid. Insoluble in water. (NTP, 1992)
1.238 g/cm3 @ Temp: 25 °C
28.5 °C
178 °C
>230 °F
1.558
H2O: Insoluble
Refrigerator
Insoluble in water.
Ketones
A nitrated ketone. Ketones are reactive with many acids and bases liberating heat and flammable gases (e.g., H2). The amount of heat may be sufficient to start a fire in the unreacted portion of the ketone. Ketones react with reducing agents such as hydrides, alkali metals, and nitrides to produce flammable gas (H2) and heat. Ketones are incompatible with isocyanates, aldehydes, cyanides, peroxides, and anhydrides. They react violently with aldehydes, HNO3, HNO3 + H2O2, and HClO4.
Safety Information
III
6.1
NONH for all modes of transport
3
22
22-24/25
AM9625000
Xn
Harmful
Stable. Combustible. Incompatible with strong oxidizing agents.
P264, P270, P301+P312, P330, P501
H302
This chemical is combustible. (NTP, 1992)
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 46 companies from 4 notifications to the ECHA C&L Inventory.
Fires involving this material should be controlled using a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
SMALL SPILLS AND LEAKAGE: If you spill this chemical, use absorbent paper to pick up all liquid spill material. Your contaminated clothing and absorbent paper should be sealed in a vapor-tight plastic bag for eventual disposal. Solvent wash all contaminated surfaces with alcohol followed by washing with a strong soap and water solution. Do not reenter the contaminated area until the Safety Officer (or other responsible person) has verified that the area has been properly cleaned. STORAGE PRECAUTIONS: You should store this material in a refrigerator. (NTP, 1992)
RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)
Drug Information
EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop. SKIN: IMMEDIATELY flood affected skin with water while removing and isolating all contaminated clothing. Gently wash all affected skin areas thoroughly with soap and water. If symptoms such as redness or irritation develop, IMMEDIATELY call a physician and be prepared to transport the victim to a hospital for treatment. INHALATION: IMMEDIATELY leave the contaminated area; take deep breaths of fresh air. If symptoms (such as wheezing, coughing, shortness of breath, or burning in the mouth, throat, or chest) develop, call a physician and be prepared to transport the victim to a hospital. Provide proper respiratory protection to rescuers entering an unknown atmosphere. Whenever possible, Self-Contained Breathing Apparatus (SCBA) should be used; if not available, use a level of protection greater than or equal to that advised under Protective Clothing. INGESTION: DO NOT INDUCE VOMITING. If the victim is conscious and not convulsing, give 1 or 2 glasses of water to dilute the chemical and IMMEDIATELY call a hospital or poison control center. Be prepared to transport the victim to a hospital if advised by a physician. If the victim is convulsing or unconscious, do not give anything by mouth, ensure that the victim's airway is open and lay the victim on his/her side with the head lower than the body. DO NOT INDUCE VOMITING. IMMEDIATELY transport the victim to a hospital. (NTP, 1992)
2′-Nitroacetophenone Use and Manufacturing
Obtained by oxidation of o-nitroethylbenzene. Add o-nitroethylbenzene, decanoic acid and initiator azobisisobutyronitrile into the reaction tower, and slowly pass air into the tower at the same time, keep the pressure 0.3-0.8MPa, and control the oxidation at 120-130℃ to produce 2- Nitroacetophenone.
Used as an intermediate for photosensitive materials. Used as a pharmaceutical intermediate
Ethanone, 1-(2-nitrophenyl)-: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Computed Properties
Molecular Weight:165.15
XLogP3:1.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:165.042593085
Monoisotopic Mass:165.042593085
Topological Polar Surface Area:62.9
Heavy Atom Count:12
Complexity:197
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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