Methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate

Modify Date: 2024-01-14 22:54:59

Methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate Structure
Methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate structure
Common Name Methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate
CAS Number 69687-80-5 Molecular Weight 153.178
Density 1.1±0.1 g/cm3 Boiling Point 294.3±35.0 °C at 760 mmHg
Molecular Formula C8H11NO2 Melting Point 115 °C
MSDS N/A Flash Point 131.8±25.9 °C

 Names

Name methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 294.3±35.0 °C at 760 mmHg
Melting Point 115 °C
Molecular Formula C8H11NO2
Molecular Weight 153.178
Flash Point 131.8±25.9 °C
Exact Mass 153.078979
PSA 42.09000
LogP 2.07
Vapour Pressure 0.0±0.6 mmHg at 25°C
Index of Refraction 1.521

 MSDS

Name: Methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate, 95+% Material Safety Data Sheet
Synonym: None Known.
CAS: 69687-80-5
Section 1 - Chemical Product MSDS Name: Methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate, 95+% Material Safety Data Sheet
Synonym: None Known.
SECTION 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
69687-80-5 Methyl 2,5-dimethyl-1H-pyrrole-3-carbo 95+% unlisted
+++++
Hazard Symbols: XI
SECTION 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW Irritating to eyes, respiratory system and skin. Potential Health Effects
Eye:
Causes eye irritation. May cause chemical conjunctivitis.
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:
No information found.
SECTION 4 - FIRST AID MEASURES
Eyes:
Immediately 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. 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:
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.
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. Clean up spills immediately, observing precautions in the Protective Equipment section. Avoid generating dusty conditions. Provide ventilation.
SECTION 7 - HANDLING and STORAGE
Handling:
Minimize dust generation and accumulation. Avoid breathing dust, vapor, mist, or gas. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation. Use with adequate ventilation. Wash clothing before reuse.
Storage:
Store in a cool, dry place. Store in a tightly closed container.
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# 69687-80-5: 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:
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: off-white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 115 - 118 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: C8H11NO2
Molecular Weight: 153
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, dust generation, excess heat.
Incompatibilities with Other Materials:
Bases, halogenated agents, halogens, strong oxidizing agents.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported
SECTION 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 69687-80-5 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate - 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 26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 37/39 Wear suitable gloves and eye/face protection. WGK (Water Danger/Protection) CAS# 69687-80-5: No information available. Canada None of the chemicals in this product are listed on the DSL/NDSL list. CAS# 69687-80-5 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 69687-80-5 is not listed on the TSCA inventory. It is for research and development use only.
SECTION 16 - ADDITIONAL INFORMATION
MSDS Creation Date: 6/10/2003 Revision #1 Date: 1/19/2005 The information above is believed to be accurate and represents the best information currently available to us. However, we make no warranty of merchantability or any other warranty, express or implied, with respect to such information, and we assume no liability resulting from its use. Users should make their own investigations to determine the suitability of the information for their particular purposes. In no way shall the company be liable for any claims, losses, or damages of any third party or for lost profits or any special, indirect, incidental, consequential or exemplary damages, howsoever arising, even if the company has been advised of the possibility of such damages.

SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

Hazard Codes Xi:Irritant;
Risk Phrases R36/37/38
Safety Phrases S26-S37
HS Code 2933990090

 Synthetic Route

~20%

Methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate Structure

Methyl 2,5-dime...

CAS#:69687-80-5

Literature: Kuwano, Ryoichi; Kashiwabara, Manabu; Ohsumi, Masato; Kusano, Hiroki Journal of the American Chemical Society, 2008 , vol. 130, # 3 p. 808 - 809

~%

Methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate Structure

Methyl 2,5-dime...

CAS#:69687-80-5

Literature: Journal of Organic Chemistry, , vol. 76, # 9 p. 3203 - 3221

~%

Methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate Structure

Methyl 2,5-dime...

CAS#:69687-80-5

Literature: Hoppe-Seyler's Zeitschrift fuer Physiologische Chemie, , vol. 246, p. 31,38

~%

Methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate Structure

Methyl 2,5-dime...

CAS#:69687-80-5

Literature: Hoppe-Seyler's Zeitschrift fuer Physiologische Chemie, , vol. 246, p. 31,38

 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

1H-Pyrrole-3-carboxylic acid, 2,5-dimethyl-, methyl ester
Methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate
2,5-Dimethyl-pyrrol-3-carbonsaeure-methylester
METHYL 2,5-DIMETHYLPYRROLE-3-CARBOXYLATE
2,5-Dimethyl-3-methoxycarbonyl-pyrrol
2,5-dimethyl-pyrrole-3-carboxylic acid methyl ester
MFCD00203859
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