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Octanoyl chloride

Octanoyl chloride structure

Octanoyl chloride 

structure
  • CAS No:

    111-64-8

  • Formula:

    C8H15ClO

  • Chemical Name:

    Octanoyl chloride

  • Synonyms:

    Octanoyl chloride;Capryloyl chloride;n-Octanoyl chloride;Caprylic acid chloride;Octanoic chloride;Octanoic acid chloride;1-Octanoic acid chloride;Octanoic acid,anhydride with carbonochloridic acid;1246204-27-2

  • Categories:

    Chemical Reagents  >  Organic Reagents

Description

clear liquidClear colorless to straw-colored liquid with a pungent odor.


Caprylyl chloride is a clear colorless to straw-colored liquid with a pungent odor. (NTP, 1992)|Liquid


Caprylyl chloride is a clear colorless to straw-colored liquid with a pungent odor. (NTP, 1992)

Octanoyl chloride Basic Attributes

162.66

162.66

635917

203-891-6

BK8FUS6OVT

1760

DTXSID9024724

29159080

Characteristics

17.1

3.64

Clear Liquid

0.985 g/cm3 @ Temp: 20 °C

-63 °C

195.6 °C

177 °F

n 20/D 1.435(lit.)

Solubility in water: reaction

−20°C

2.5 mm Hg ( 20 °C)

5.6 (NTP, 1992) (Relative to Air)

Flammable; decomposes toxic hydrogen chloride gas in case of heat or water

Reacts vigorously with water to form HCl and caprylic acid. Insoluble in water.

Acyl Halides, Sulfonyl Halides, and Chloroformates

Water-Reactive

CAPRYLYL CHLORIDE is incompatible with bases (including amines), water, alcohols, and with oxidizing agents (NTP, 1992). May react vigorously or explosively if mixed with diisopropyl ether or other ethers in the presence of trace amounts of metal salts [J. Haz. Mat., 1981, 4, 291].

Safety Information

II

8

UN 3265 8/PG 2

3

34-22-43-41-38-23

26-36/37/39-45-25-39-37-24

RH1570000

C,T

The warehouse is ventilated, low temperature and dry; stored separately from oxidants and alkalis

P260-P280-P284-P305 + P351 + P338-P310

H290-H315-H317-H318-H330

This chemical is combustible. (NTP, 1992)|Corrosives, Flammable - 2nd degree, Reactive - 1st degree

|Danger|H290 (95.92%): May be corrosive to metals [Warning Corrosive to Metals]|P234, P260, P261, P264, P271, P272, P280, P284, P302+P352, P304+P340, P305+P351+P338, P310, P320, P321, P332+P313, P333+P313, P362, P363, P390, P403+P233, P404, P405, and P501|Aggregated GHS information provided by 147 companies from 6 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 chemical, carbon dioxide or Halon extinguisher. (NTP, 1992)

Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-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: If you should 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 acetone 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 keep this material in a tightly closed container under an inert atmosphere, and store it at refrigerated temperatures. STORE AWAY FROM SOURCES OF IGNITION. (NTP, 1992)

MINIMUM PROTECTIVE CLOTHING: If Tyvek-type disposable protective clothing is not worn during handling of this chemical, wear disposable Tyvek-type sleeves taped to your gloves. RECOMMENDED RESPIRATOR: When working with this chemical, wear a NIOSH-approved full face chemical cartridge respirator equipped with the appropriate organic vapor cartridges. If that is not available, a half face respirator similarly equipped plus airtight goggles can be substituted. However, please note that half face respirators provide a substantially lower level of protection than do full face respirators. (NTP, 1992)

Drug Information

SYMPTOMS: Symptoms of exposure to this compound may include eye and skin irritation. Inhalation may be fatal as a result of spasm, inflammation and edema of the larynx and bronchi, chemical pneumonitis and pulmonary edema. Other symptoms include a burning sensation, coughing, wheezing, laryngitis, shortness of breath, headache, nausea, vomiting and lacrimation. This compound is extremely destructive to tissue of the mucous membranes, upper respiratory tract, eyes and skin. ACUTE/CHRONIC HAZARDS: This compound is a lacrimator. It is an irritant to the eyes and skin. It is extremely destructive to tissue of the mucous membranes, upper respiratory tract, eyes and skin. When heated to decomposition it emits toxic fumes of carbon monoxide, carbon dioxide, hydrogen chloride gas and phosgene gas. (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. IMMEDIATELY call a hospital or poison control center even if no symptoms (such as redness or irritation) develop. IMMEDIATELY transport the victim to a hospital for treatment after washing the affected areas. 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. Corrosive chemicals will destroy the membranes of the mouth, throat, and esophagus and, in addition, have a high risk of being aspirated into the victim's lungs during vomiting which increases the medical problems. 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. IMMEDIATELY transport the victim to a hospital. 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. Transport the victim IMMEDIATELY to a hospital. (NTP, 1992)

Octanoyl chloride Use and Manufacturing

Uses

Used as liquid crystal intermediate, also used in rubber industry, capable of producing adhesives


Intermediates

All other basic organic chemical manufacturing|Octanoyl chloride: ACTIVE

Fire Hazards -> Corrosives, Flammable - 2nd degree, Reactive - 1st degree

Computed Properties

Molecular Weight:162.66
XLogP3:4
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:6
Exact Mass:162.0811428
Monoisotopic Mass:162.0811428
Topological Polar Surface Area:17.1
Heavy Atom Count:10
Complexity:91.3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Material

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