1-tosyl-1H-pyrrole-3-carboxylic acid

Modify Date: 2024-01-09 18:30:19

1-tosyl-1H-pyrrole-3-carboxylic acid Structure
1-tosyl-1H-pyrrole-3-carboxylic acid structure
Common Name 1-tosyl-1H-pyrrole-3-carboxylic acid
CAS Number 106058-86-0 Molecular Weight 265.285
Density 1.4±0.1 g/cm3 Boiling Point 501.8±52.0 °C at 760 mmHg
Molecular Formula C12H11NO4S Melting Point 202-206 °C
MSDS N/A Flash Point 257.3±30.7 °C

 Names

Name N-Tosyl-3-pyrrolecarboxylic Acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.4±0.1 g/cm3
Boiling Point 501.8±52.0 °C at 760 mmHg
Melting Point 202-206 °C
Molecular Formula C12H11NO4S
Molecular Weight 265.285
Flash Point 257.3±30.7 °C
Exact Mass 265.040863
PSA 84.75000
LogP 2.41
Vapour Pressure 0.0±1.4 mmHg at 25°C
Index of Refraction 1.620

 MSDS

Name: n-Tosyl-3-pyrrolecarboxylic acid 96% Material Safety Data Sheet
Synonym:
CAS: 106058-86-0
Section 1 - Chemical Product MSDS Name:n-Tosyl-3-pyrrolecarboxylic acid 96% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
106058-86-0 N-Tosyl-3-pyrrolecarboxylic acid, 96% 96% unlisted
Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
The toxicological properties of this material have not been fully investigated.
Potential Health Effects
Eye:
No information regarding eye irritation and other potential effects was found.
Skin:
No information regarding skin irritation and other potential effects was found.
Ingestion:
The toxicological properties of this substance have not been fully investigated.
Inhalation:
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:
Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Get medical aid if irritation develops or persists.
Ingestion:
If victim is conscious and alert, give 2-4 cupfuls of milk or water.
Get medical aid.
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 if cough or other symptoms appear.
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, 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:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower.
Exposure Limits CAS# 106058-86-0: Personal Protective Equipment Eyes: Wear chemical splash goggles.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear a chemical apron.
Respirators:
A NIOSH/MSHA approved air purifying dust or mist respirator or European Standard EN 149.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Solid
Color: brown
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 199 - 202 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: C11H9NO4
Molecular Weight: 265.29

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not available.
Conditions to Avoid:
Not available.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, oxides of nitrogen, oxides of sulfur, carbon dioxide.
Hazardous Polymerization: Has not been reported.

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 106058-86-0 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
N-Tosyl-3-pyrrolecarboxylic acid, 96% - 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: Not available.
Risk Phrases:
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
WGK (Water Danger/Protection)
CAS# 106058-86-0: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 106058-86-0 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 106058-86-0 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

Safety Phrases S24/25
HS Code 2933990090

 Synthetic Route

~97%

1-tosyl-1H-pyrrole-3-carboxylic acid Structure

1-tosyl-1H-pyrr...

CAS#:106058-86-0

Literature: Heterocycles, , vol. 60, # 10 p. 2315 - 2321

 Precursor & DownStream

Precursor  1

DownStream  0

 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

1-tosyl-1H-pyrrole-3-carboxylic acid
1-[(4-Methylphenyl)sulfonyl]-1H-pyrrole-3-carboxylic acid
1H-Pyrrole-3-carboxylic acid, 1-[(4-methylphenyl)sulfonyl]-
1-(4-methylphenyl)sulfonylpyrrole-3-carboxylic acid
N-Tosyl-pyrrole-3-carboxylic acid
MFCD00145013