N-(2-Cyanoethyl)pyrrole

Modify Date: 2024-01-02 12:27:55

N-(2-Cyanoethyl)pyrrole Structure
N-(2-Cyanoethyl)pyrrole structure
Common Name N-(2-Cyanoethyl)pyrrole
CAS Number 43036-06-2 Molecular Weight 120.152
Density 1.0±0.1 g/cm3 Boiling Point 266.8±0.0 °C at 760 mmHg
Molecular Formula C7H8N2 Melting Point N/A
MSDS N/A Flash Point 104.4±22.6 °C

 Names

Name n-(2-cyanoethyl)pyrrole
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.0±0.1 g/cm3
Boiling Point 266.8±0.0 °C at 760 mmHg
Molecular Formula C7H8N2
Molecular Weight 120.152
Flash Point 104.4±22.6 °C
Exact Mass 120.068748
PSA 28.72000
LogP 0.70
Vapour Pressure 0.0±0.5 mmHg at 25°C
Index of Refraction 1.527
Storage condition 2-8°C

 MSDS

Name: N-(2-Cyanoethyl)pyrrole 99+% Material Safety Data Sheet
Synonym: 1-Pyrrolepropionitrile; 1-(2-Cyanoethyl)pyrrole; 3-(Pyrrol-1-yl)propiononitrile
CAS: 43036-06-2
Section 1 - Chemical Product MSDS Name:N-(2-Cyanoethyl)pyrrole 99+% Material Safety Data Sheet
Synonym:1-Pyrrolepropionitrile; 1-(2-Cyanoethyl)pyrrole; 3-(Pyrrol-1-yl)propiononitrile

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
43036-06-2 N-(2-Cyanoethyl)pyrrole >99 256-051-6
Hazard Symbols: XN
Risk Phrases: 20/21

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Harmful by inhalation and in contact with skin.
Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
Causes respiratory tract irritation. May be harmful if inhaled.
Chronic:
May be metabolized to cyanide which in turn acts by inhibiting cytochrome oxidase impairing cellular respiration. Chronic exposure to cyanide solutions may lead to the development of a "cyanide" rash, characterized by itching, and by macular, papular, and vesicular eruptions, and may be accompanied by secondary infections. Exposure to small amounts of cyanide compounds over long periods of time is reported to cause loss of appetite, headache, weakness, nausea, dizziness, and symptoms of irritation of the upper respiratory tract and eyes.

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.
Notes to Physician:

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. 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:
Do NOT get water inside containers. For small fires, use dry chemical, carbon dioxide, or water spray. For large fires, use dry chemical, carbon dioxide, alcohol-resistant foam, or water spray.
Cool containers with flooding quantities of water until well after fire is out.

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. Provide ventilation.

Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Use with adequate ventilation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed.
Avoid ingestion and inhalation.
Storage:
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# 43036-06-2: Personal Protective Equipment Eyes: Wear chemical splash goggles.
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: clear yellow
Odor: none reported
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 132-133 deg C @ 10 mmHg
Freezing/Melting Point: Not available.
Autoignition Temperature: Not available.
Flash Point: > 112 deg C (> 233.60 deg F)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density: 1.0480g/cm3
Molecular Formula: C7H8N2
Molecular Weight: 120.15

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions.
Conditions to Avoid:
Excess heat.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Hydrogen cyanide, carbon monoxide, oxides of nitrogen, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 43036-06-2 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
N-(2-Cyanoethyl)pyrrole - 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
Shipping Name: TOXIC LIQUID, ORGANIC, N.O.S.*
Hazard Class: 6.1
UN Number: 2810
Packing Group: I
IMO
Shipping Name: TOXIC LIQUID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2810
Packing Group: I
RID/ADR
Shipping Name: TOXIC LIQUID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2810
Packing group: I

Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XN
Risk Phrases:
R 20/21 Harmful by inhalation and in contact with
skin.
Safety Phrases:
S 23 Do not inhale gas/fumes/vapour/spray.
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# 43036-06-2: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 43036-06-2 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 43036-06-2 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

Hazard Codes Xn: Harmful;
Risk Phrases R20/21
Safety Phrases S23
RIDADR UN 2810
HS Code 2933990090

 Synthetic Route

~87%

N-(2-Cyanoethyl)pyrrole Structure

N-(2-Cyanoethyl...

CAS#:43036-06-2

Literature: Taylor, James E.; Jones, Matthew D.; Williams, Jonathan M. J.; Bull, Steven D. Organic Letters, 2010 , vol. 12, # 24 p. 5740 - 5743

~30%

N-(2-Cyanoethyl)pyrrole Structure

N-(2-Cyanoethyl...

CAS#:43036-06-2

Literature: Dieltiens, Nicolai; Stevens, Christian V.; Vos, David De; Allaert, Bart; Drozdzak, Renata; Verpoort, Francis Tetrahedron Letters, 2004 , vol. 45, # 49 p. 8995 - 8998

~%

N-(2-Cyanoethyl)pyrrole Structure

N-(2-Cyanoethyl...

CAS#:43036-06-2

Literature: Herz et al. Journal of Organic Chemistry, 1956 , vol. 21, p. 896

~%

N-(2-Cyanoethyl)pyrrole Structure

N-(2-Cyanoethyl...

CAS#:43036-06-2

Literature: Clemo; Ramage Journal of the Chemical Society, 1931 , p. 49,54

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

pyrrole-1-propionitrile
MFCD00003092
3-(1H-Pyrrol-1-yl)propanenitrile
N-(2-Cyanoethyl)pyrrole
EINECS 256-051-6
N-(2-Cyanoethyl)-pyrrole
1H-Pyrrole-1-propanenitrile
3-pyrrol-1-ylpropanenitrile