3-(diethylamino)propionitrile

Modify Date: 2024-01-09 14:42:58

3-(diethylamino)propionitrile Structure
3-(diethylamino)propionitrile structure
Common Name 3-(diethylamino)propionitrile
CAS Number 5351-04-2 Molecular Weight 126.19900
Density 0.86 Boiling Point 197 °C
Molecular Formula C7H14N2 Melting Point -64 ℃
MSDS N/A Flash Point 79 °C

 Names

Name 3-(diethylamino)propanenitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 0.86
Boiling Point 197 °C
Melting Point -64 ℃
Molecular Formula C7H14N2
Molecular Weight 126.19900
Flash Point 79 °C
Exact Mass 126.11600
PSA 27.03000
LogP 1.24188
Index of Refraction 1.4345-1.4365

 MSDS

Name: 3-(Diethylamino)propionitrile 98% Material Safety Data Sheet
Synonym: None known
CAS: 5351-04-2
Section 1 - Chemical Product MSDS Name:3-(Diethylamino)propionitrile 98% Material Safety Data Sheet
Synonym:None known

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
5351-04-2 3-(Diethylamino)propionitrile 98 226-323-9
Hazard Symbols: XI
Risk Phrases: 36/37/38

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin.
Potential Health Effects
Eye:
Causes eye irritation. May cause chemical conjunctivitis and corneal damage.
Skin:
Causes skin irritation. May cause irritation and dermatitis. May cause cyanosis of the extremities.
Ingestion:
May cause gastrointestinal irritation with nausea, vomiting and diarrhea. The toxicological properties of this substance have not been fully investigated.
Inhalation:
Causes respiratory tract irritation. The toxicological properties of this substance have not been fully investigated. Aspiration may lead to pulmonary edema. Can produce delayed pulmonary edema. Inhalation at high concentrations may cause CNS depression and asphixiation.
Chronic:
Effects may be delayed.

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. Wash clothing before reuse.
Ingestion:
Never give anything by mouth to an unconscious person. Get medical aid. Do NOT induce vomiting. If conscious and alert, rinse mouth and drink 2-4 cupfuls of milk or 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. Do NOT use mouth-to-mouth resuscitation.
Notes to Physician:
Treat symptomatically and supportively.

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. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion. Use water spray to keep fire-exposed containers cool. Water may be ineffective.
Material is lighter than water and a fire may be spread by the use of water. Combustible liquid. Vapors may be heavier than air. They can spread along the ground and collect in low or confined areas.
Containers may explode when heated.
Extinguishing Media:
Use water spray to cool fire-exposed containers. Use agent most appropriate to extinguish fire. Use water spray, dry chemical, carbon dioxide, or appropriate 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. Avoid runoff into storm sewers and ditches which lead to waterways. Clean up spills immediately, observing precautions in the Protective Equipment section. Remove all sources of ignition. Use a spark-proof tool. Provide ventilation.

Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use with adequate ventilation. Avoid contact with eyes, skin, and clothing. Empty containers retain product residue, (liquid and/or vapor), and can be dangerous. Keep container tightly closed. Keep away from heat, sparks and flame. Avoid ingestion and inhalation. Do not pressurize, cut, weld, braze, solder, drill, grind, or expose empty containers to heat, sparks or open flames.
Storage:
Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 5351-04-2: Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Liquid
Color: light yellow
Odor: None reported.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 197 deg C @ 760.00mm Hg
Freezing/Melting Point: -64 deg C
Autoignition Temperature: 285 deg C ( 545.00 deg F)
Flash Point: 79 deg C ( 174.20 deg F)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density: .8650g/cm3
Molecular Formula: C7H14N2
Molecular Weight: 126.20

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions.
Conditions to Avoid:
Incompatible materials, ignition sources, excess heat, strong oxidants.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, irritating and toxic fumes and gases, carbon dioxide.
Hazardous Polymerization: Has not been reported.

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 5351-04-2 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
3-(Diethylamino)propionitrile - 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
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XI
Risk Phrases:
R 36/37/38 Irritating to eyes, respiratory system
and skin.
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
S 28A After contact with skin, wash immediately with
plenty of water.
S 37 Wear suitable gloves.
S 45 In case of accident or if you feel unwell, seek
medical advice immediately (show the label where
possible).
WGK (Water Danger/Protection)
CAS# 5351-04-2: 2
Canada
CAS# 5351-04-2 is listed on Canada's NDSL List.
CAS# 5351-04-2 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 5351-04-2 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

Hazard Codes Xi,Xn
Risk Phrases 36/37/38
Safety Phrases 24/25
HS Code 2926909090

 Synthetic Route

~99%

3-(diethylamino)propionitrile Structure

3-(diethylamino...

CAS#:5351-04-2

Literature: Xu, Li-Wen; Li, Lyi; Xia, Chun-Gu Helvetica Chimica Acta, 2004 , vol. 87, # 6 p. 1522 - 1526

~82%

3-(diethylamino)propionitrile Structure

3-(diethylamino...

CAS#:5351-04-2

Literature: Zou, Bo; Jiang, Huan-Feng; Wang, Zhao-Yang European Journal of Organic Chemistry, 2007 , # 27 p. 4600 - 4604

~20%

3-(diethylamino)propionitrile Structure

3-(diethylamino...

CAS#:5351-04-2

Detail
Literature: Kim, Jin-Il; Patel, Babu A.; Heck, Richard F. Journal of Organic Chemistry, 1981 , vol. 46, # 6 p. 1067 - 1073

~%

3-(diethylamino)propionitrile Structure

3-(diethylamino...

CAS#:5351-04-2

Literature: Utermohlen; Hamilton Journal of the American Chemical Society, 1941 , vol. 63, p. 156,158

~%

3-(diethylamino)propionitrile Structure

3-(diethylamino...

CAS#:5351-04-2

Literature: Morimoto Takeda Kenkyusho Nenpo, 1950 , vol. 9, p. 20,21 Chem.Abstr., 1952 , p. 2489

~%

3-(diethylamino)propionitrile Structure

3-(diethylamino...

CAS#:5351-04-2

Literature: Butskus,P.F. J. Gen. Chem. USSR (Engl. Transl.), 1960 , vol. 30, p. 1816 - 1818,1799 - 1800

 Customs

HS Code 2926909090
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%

 Synonyms

3-Diethylaminopropiononitrile
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