3-(Diethylamino)phenol
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3-(Diethylamino)phenol
structure -
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CAS No:
91-68-9
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Formula:
C10H15NO
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Chemical Name:
3-(Diethylamino)phenol
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Synonyms:
Phenol,3-(diethylamino)-;Phenol,m-(diethylamino)-;3-(Diethylamino)phenol;m-(Diethylamino)phenol;N,N-Diethyl-m-aminophenol;3-Hydroxy-N,N-diethylaniline;N,N-Diethyl-3-hydroxyaniline;N,N-Diethyl-3-aminophenol;m-Hydroxy-N,N-diethylaniline;NSC 93934;3-(N,N-Diethylamino)phenol;N,N-Diethyl-3-Hydroxybenzenamine
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CAS No:
Description
Grey-brown to rose or red flakes or granules
3-diethylaminophenol is a black solid. (NTP, 1992)|DryPowder
3-diethylaminophenol is a black solid. (NTP, 1992)
3-(Diethylamino)phenol Basic Attributes
165.23
165.23
202-090-9
BQY98Q7YU5
93934
2512
DTXSID9025037
29222900
Characteristics
23.5
2.3
Gray-brown to rose or red Flakes or Granules
1.04g/cm3
78 °C
276 °C
141 °C
1.564
less than 1 mg/mL at 68.9° F (NTP, 1992)
Refrigerator
Insoluble in water.
Amines, Phosphines, and Pyridines
An amine and phenol. Amines are chemical bases. They neutralize acids to form salts plus water. These acid-base reactions are exothermic. The amount of heat that is evolved per mole of amine in a neutralization is largely independent of the strength of the amine as a base. Amines may be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen is generated by amines in combination with strong reducing agents, such as hydrides. Phenols do not behave as organic alcohols, as one might guess from the presence of a hydroxyl (-OH) group in their structure. Instead, they react as weak organic acids. Phenols and cresols are much weaker as acids than common carboxylic acids (phenol has pKa = 9.88). These materials are incompatible with strong reducing substances such as hydrides, nitrides, alkali metals, and sulfides. Flammable gas (H2) is often generated, and the heat of the reaction may ignite the gas. Heat is also generated by the acid-base reaction between phenols and bases. Such heating may initiate polymerization of the organic compound. Phenols are sulfonated very readily (for example, by concentrated sulfuric acid at room temperature). The reactions generate heat. Phenols are also nitrated very rapidly, even by dilute nitric acid.
Safety Information
III
6.1
UN 2512 6.1/PG 3
2
25-36/37/38
36/37/39-45-22-26-36-24/25
SL0550500
T,Xi
Stable under normal temperatures and pressures.
P261-P305 + P351 + P338
H315-H319-H335
Flash point data are not available for this chemical, but it is probably combustible. (NTP, 1992)
|Danger|H301 (68.53%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P273, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P391, P403+P233, P405, and P501|Aggregated GHS information provided by 143 companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Fires involving this compound should be controlled using a dry chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)
Excerpt from ERG Guide 152 [Substances - Toxic (Combustible)]: As an immediate precautionary measure, isolate spill or leak area in all directions for at least 50 meters (150 feet) for liquids and at least 25 meters (75 feet) for solids. SPILL: Increase, in the downwind direction, as necessary, the isolation distance shown above. FIRE: If tank, rail car or tank truck is involved in a fire, ISOLATE for 800 meters (1/2 mile) in all directions; also, consider initial evacuation for 800 meters (1/2 mile) in all directions. (ERG, 2016)
SMALL SPILLS AND LEAKAGE: Should a spill occur while you are handling this chemical, you should dampen the solid spill material with alcohol, then transfer the dampened material to a suitable container. Use absorbent paper dampened with alcohol to pick up any remaining material. Seal the absorbent paper, and any of your clothes, which may be contaminated, 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 contaminate 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
ACUTE/CHRONIC HAZARDS: This compound may cause irritation on contact. (NTP, 1992)
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)
3-(Diethylamino)phenol Use and Manufacturing
Sodium m-nitrobenzene sulfonate is reduced with iron powder to sodium m-aminobenzene sulfonate, then alkylated with ethyl chloride, then fused with sodium hydroxide, and finally acidified to obtain the finished product.
Used as a dye intermediate for rose essence, acid pink, basic ruddy red, etc.
Intermediates
Synthetic dye and pigment manufacturing|Phenol, 3-(diethylamino)-: ACTIVE
Cosmetics -> Hair dyeing
Computed Properties
Molecular Weight:165.23
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:165.115364102
Monoisotopic Mass:165.115364102
Topological Polar Surface Area:23.5
Heavy Atom Count:12
Complexity:123
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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