2-(4-Phenylthiazol-2-Yl)Acetonitrile

Modify Date: 2024-01-04 21:01:54

2-(4-Phenylthiazol-2-Yl)Acetonitrile Structure
2-(4-Phenylthiazol-2-Yl)Acetonitrile structure
Common Name 2-(4-Phenylthiazol-2-Yl)Acetonitrile
CAS Number 41381-89-9 Molecular Weight 200.26000
Density 1.223g/cm3 Boiling Point 378.5ºC at 760mmHg
Molecular Formula C11H8N2S Melting Point 59ºC
MSDS N/A Flash Point 182.7ºC

 Names

Name 2-(4-phenyl-1,3-thiazol-2-yl)acetonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.223g/cm3
Boiling Point 378.5ºC at 760mmHg
Melting Point 59ºC
Molecular Formula C11H8N2S
Molecular Weight 200.26000
Flash Point 182.7ºC
Exact Mass 200.04100
PSA 64.92000
LogP 2.87618
Index of Refraction 1.61

 MSDS

Name: 2-(4-Phenyl-1 3-thiazol-2-yl)acetonitrile 97% Material Safety Data Sheet
Synonym:
CAS: 41381-89-9
Section 1 - Chemical Product MSDS Name:2-(4-Phenyl-1 3-thiazol-2-yl)acetonitrile 97% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
41381-89-9 2-(4-Phenyl-1,3-thiazol-2-yl)acetonitr 97% unlisted
Hazard Symbols: XN
Risk Phrases: 20/21/22

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Harmful by inhalation, in 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 water spray, dry chemical, carbon dioxide, or chemical foam.

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.
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# 41381-89-9: 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: Solid
Color: Not available.
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 58 - 60 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: C11H8N2S
Molecular Weight: 200

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Hydrogen cyanide, nitrogen oxides, carbon monoxide, oxides of sulfur, carbon dioxide, acrid smoke and fumes.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 41381-89-9 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
2-(4-Phenyl-1,3-thiazol-2-yl)acetonitrile - 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: NITRILES, SOLID, TOXIC, N.O.S.*
Hazard Class: 6.1
UN Number: 3276
Packing Group: III
IMO
Shipping Name: NITRILES, TOXIC, N.O.S.
Hazard Class: 6.1
UN Number: 3276
Packing Group: III
RID/ADR
Shipping Name: NITRILES, TOXIC, N.O.S.
Hazard Class: 6.1
UN Number: 3276
Packing group: III

Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XN
Risk Phrases:
R 20/21/22 Harmful by inhalation, in contact with
skin and if swallowed.
Safety Phrases:
S 36/37 Wear suitable protective clothing and
gloves.
WGK (Water Danger/Protection)
CAS# 41381-89-9: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 41381-89-9 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 41381-89-9 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 Xi: Irritant;
Risk Phrases R20/21/22
Safety Phrases 26-36/37/39
RIDADR UN 3276
HS Code 2934100090

 Synthetic Route

~86%

2-(4-Phenylthiazol-2-Yl)Acetonitrile Structure

2-(4-Phenylthia...

CAS#:41381-89-9

Literature: NOVUSPHARMA S.P.A. Patent: WO2003/105842 A1, 2003 ; Location in patent: Page 65 - 66 ;

~71%

2-(4-Phenylthiazol-2-Yl)Acetonitrile Structure

2-(4-Phenylthia...

CAS#:41381-89-9

Literature: Shionogi and Co., Ltd. Patent: EP2351744 A1, 2011 ; Location in patent: Page/Page column 59-60 ;

~%

2-(4-Phenylthiazol-2-Yl)Acetonitrile Structure

2-(4-Phenylthia...

CAS#:41381-89-9

Literature: Hussain, Sohair Mohamed; El-Reedy, Ahmed Mohamed; El-Sharabasy, Salwa Ahmed Tetrahedron, 1988 , vol. 44, # 1 p. 241 - 246

~%

2-(4-Phenylthiazol-2-Yl)Acetonitrile Structure

2-(4-Phenylthia...

CAS#:41381-89-9

Literature: Hussain, Sohair Mohamed; El-Reedy, Ahmed Mohamed; El-Sharabasy, Salwa Ahmed Tetrahedron, 1988 , vol. 44, # 1 p. 241 - 246

~%

2-(4-Phenylthiazol-2-Yl)Acetonitrile Structure

2-(4-Phenylthia...

CAS#:41381-89-9

Literature: Shionogi and Co., Ltd. Patent: EP2351744 A1, 2011 ;

 Customs

HS Code 2934100090
Summary 2934100090 other compounds containing an unfused thiazole ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%

 Synonyms

4-phenylthiazol-2-acetonitrile
(4-phenyl-1,3-thiazol-2-yl)-acetonitrile
2-(4-phenyl-1,3-thiazol-2-yl)ethanenitrile
4-phenylthiazol-2-yl-acetonitrile
2-cyanomethyl-4-phenyl-thiazole
2-(4-Phenylthiazol-2-yl)acetonitrile
MFCD00551791
2-thiazoleacetonitrile,4-phenyl
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