Valeronitrile
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Valeronitrile
structure -
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CAS No:
110-59-8
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Formula:
C5H9N
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Chemical Name:
Valeronitrile
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Synonyms:
Pentanenitrile;Valeronitrile;Butane,1-cyano-;Butyl cyanide;1-Cyanobutane;1-Butyl cyanide;n-Valeronitrile;n-Pentanenitrile;n-Butyl cyanide
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CAS No:
Description
Clear liquidClear colorless to yellow liquid.
Valeronitrile is a clear colorless to yellow liquid. (NTP, 1992)|Liquid
Valeronitrile is a clear colorless to yellow liquid. (NTP, 1992)
Valeronitrile Basic Attributes
83.134
83.13
203-781-8
X44H3R47D4
3273
DTXSID3026275
29269095 29332100
Characteristics
23.8
1.12
Valeronitrile is a clear colorless to yellow liquid. (NTP, 1992)
0.80361 g/cm3 @ Temp: 15 °C
-96.2 °C
141.3 °C
105° F (NTP, 1992)
n 20/D 1.397(lit.)
H2O: 10.0g/l
Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Flammables-area.
7.0 hPa (20 °C)
LD50 orally in male mice: 2.297 mmol/kg (Tanii)
Slightly soluble in water.
Nitriles
Highly Flammable
Nitriles, such as VALERONITRILE, may polymerize in the presence of metals and some metal compounds. They are incompatible with acids; mixing nitriles with strong oxidizing acids can lead to extremely violent reactions. Nitriles are generally incompatible with other oxidizing agents such as peroxides and epoxides. The combination of bases and nitriles can produce hydrogen cyanide. Nitriles are hydrolyzed in both aqueous acid and base to give carboxylic acids (or salts of carboxylic acids). These reactions generate heat. Peroxides convert nitriles to amides. Nitriles can react vigorously with reducing agents. Acetonitrile and propionitrile are soluble in water, but nitriles higher than propionitrile have low aqueous solubility. They are also insoluble in aqueous acids. This compound is incompatible with strong acids, strong bases, strong oxidizing agents and strong reducing agents. (NTP, 1992).
Safety Information
III
3
UN 1992 3/PG 3
3
R10;R25
36/37/39-45-16
YV8195000
T
Stable. Incompatible with strong acids, strong bases, strong oxidizing agents, strong reducing agents. Flammable.
P301 + P310
H226-H301
This chemical is combustible. (NTP, 1992)
|Danger|H226 (98.44%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P310, P301+P312, P303+P361+P353, P321, P330, P370+P378, P403+P235, P405, and P501|Aggregated GHS information provided by 64 companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Fires involving this material can be controlled with a dry chemi cal, carbon dioxide or Halon extinguisher. (NTP, 1992)
Excerpt from ERG Guide 131 [Flammable Liquids - Toxic]: As an immediate precautionary measure, isolate spill or leak area for at least 50 meters (150 feet) in all directions. 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: If you spill this chemical, FIRST REMOVE ALL SOURCES OF IGNITION. Then, 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 60-70% ethanol followed by washing with a 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
SYMPTOMS: Exposure to this compound may cause irritation. ACUTE/CHRONIC HAZARDS: This compound may be harmful by inhalation, ingestion or skin absorption. When heated to decomposition this compound may produce carbon monoxide, carbon dioxide and NOx. (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)
n-valeronitrile
Valeronitrile Use and Manufacturing
Valeronitrile is used as building block in organic synthesis. Product Data Sheet Solvent.Valeronitrile is used as an industrial solvent and as a chemical intermediate.
Pentanenitrile: ACTIVE
Computed Properties
Molecular Weight:83.13
XLogP3:1.1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:83.073499291
Monoisotopic Mass:83.073499291
Topological Polar Surface Area:23.8
Heavy Atom Count:6
Complexity:57.6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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