N,N-Bis(cyanoethyl)aniline

Modify Date: 2024-01-02 15:52:15

N,N-Bis(cyanoethyl)aniline Structure
N,N-Bis(cyanoethyl)aniline structure
Common Name N,N-Bis(cyanoethyl)aniline
CAS Number 1555-66-4 Molecular Weight 199.25200
Density 1.105g/cm3 Boiling Point 175 - 180 (0.3 torr)
Molecular Formula C12H13N3 Melting Point 81-84 °C(lit.)
MSDS N/A Flash Point 189ºC

 Names

Name 3-[N-(2-cyanoethyl)anilino]propanenitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.105g/cm3
Boiling Point 175 - 180 (0.3 torr)
Melting Point 81-84 °C(lit.)
Molecular Formula C12H13N3
Molecular Weight 199.25200
Flash Point 189ºC
Exact Mass 199.11100
PSA 50.82000
LogP 2.32036
Vapour Pressure 5.35E-07mmHg at 25°C
Index of Refraction 1.567

 MSDS

Name: n n-bis(Cyanoethyl)aniline 95% Material Safety Data Sheet
Synonym:
CAS: 1555-66-4
Section 1 - Chemical Product MSDS Name:n n-bis(Cyanoethyl)aniline 95% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
1555-66-4 N,N-Bis(cyanoethyl)aniline 95% 216-306-4
Hazard Symbols: T N
Risk Phrases: 20/21/22 40 50 48/23/24/25

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Harmful by inhalation, in contact with skin and if swallowed.
Limited evidence of a carcinogenic effect. Very toxic to aquatic organisms. Toxic : danger of serious damage to health by prolonged exposure through inhalation, contact with skin and if swallowed.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation. Harmful if absorbed through the skin.
Ingestion:
Harmful if swallowed. May cause irritation of the digestive tract.
Inhalation:
Harmful if inhaled. May cause respiratory tract irritation.
Chronic:
Not available.

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.
Ingestion:
Get medical aid. Wash mouth out with 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.
Extinguishing Media:
Use foam, dry chemical, or carbon dioxide.

Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Vacuum or sweep up material and place into a suitable disposal container.

Section 7 - HANDLING and STORAGE
Handling:
Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes. Use only in a chemical fume hood.
Storage:
Store in a cool, dry place. Store in a tightly closed container.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 1555-66-4: Personal Protective Equipment Eyes: Not available.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Powder
Color: light beige
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 80 - 88 deg C
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C12H13N3
Molecular Weight: 199.25

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents, acids, acetic anhydride, acid chlorides, carbon dioxide.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 1555-66-4 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
N,N-Bis(cyanoethyl)aniline - 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 SOLID, ORGANIC, N.O.S.*
Hazard Class: 6.1
UN Number: 2811
Packing Group: 3
IMO
Shipping Name: TOXIC SOLID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2811
Packing Group: 3
RID/ADR
Shipping Name: TOXIC SOLID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2811
Packing group: III

Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: T N
Risk Phrases:
R 20/21/22 Harmful by inhalation, in contact with
skin and if swallowed.
R 40 Limited evidence of a carcinogenic effect.
R 48/23/24/25 Toxic : danger of serious damage to
health by prolonged exposure through inhalation,
contact with skin and if swallowed.
R 50 Very toxic to aquatic organisms.
Safety Phrases:
S 28A After contact with skin, wash immediately with
plenty of water.
S 36/37 Wear suitable protective clothing and
gloves.
S 45 In case of accident or if you feel unwell, seek
medical advice immediately (show the label where
possible).
S 61 Avoid release to the environment. Refer to
special instructions/safety data sheets.
WGK (Water Danger/Protection)
CAS# 1555-66-4: No information available.
Canada
CAS# 1555-66-4 is listed on Canada's NDSL List.
CAS# 1555-66-4 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 1555-66-4 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

Hazard Codes Xi:Irritant;
Risk Phrases R36/37/38
Safety Phrases S26-S36
WGK Germany 3

 Synthetic Route

~%

N,N-Bis(cyanoethyl)aniline Structure

N,N-Bis(cyanoet...

CAS#:1555-66-4

Literature: Journal of the American Chemical Society, , vol. 74, p. 1096

~%

N,N-Bis(cyanoethyl)aniline Structure

N,N-Bis(cyanoet...

CAS#:1555-66-4

Literature: Journal of the Chemical Society, , p. 67,71

~%

N,N-Bis(cyanoethyl)aniline Structure

N,N-Bis(cyanoet...

CAS#:1555-66-4

Literature: Journal of the Chemical Society, , p. 1536,1542

~%

N,N-Bis(cyanoethyl)aniline Structure

N,N-Bis(cyanoet...

CAS#:1555-66-4

Literature: Journal of the Chemical Society, , p. 1536,1542

~%

N,N-Bis(cyanoethyl)aniline Structure

N,N-Bis(cyanoet...

CAS#:1555-66-4

Detail
Literature: Journal of the Chemical Society, , p. 67,71

 Synonyms

3,3'-Phenylimino-di-propionitril
EINECS 216-306-4
N,N-Bis(2-cyanoethyl)aniline
bis-2-cyanoethyl aniline
MFCD00019855
3,3'-(Phenylimino)dipropionitrile