Methyl orotate

Modify Date: 2024-01-06 09:14:03

Methyl orotate Structure
Methyl orotate structure
Common Name Methyl orotate
CAS Number 6153-44-2 Molecular Weight 170.123
Density 1.4±0.1 g/cm3 Boiling Point 299.73°C (rough estimate)
Molecular Formula C6H6N2O4 Melting Point 244ºC
MSDS N/A Flash Point N/A

 Names

Name Methyl orotate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.4±0.1 g/cm3
Boiling Point 299.73°C (rough estimate)
Melting Point 244ºC
Molecular Formula C6H6N2O4
Molecular Weight 170.123
Exact Mass 170.032761
PSA 92.02000
LogP -1.16
Index of Refraction 1.509

 MSDS

Name: Methyl orotate 99% Material Safety Data Sheet
Synonym: Orotic acid methyl ester; Methyl 1,2,3,6-tetrahydro-2,6-dioxopyrimidine-4-carboxylat
CAS: 6153-44-2
Section 1 - Chemical Product MSDS Name:Methyl orotate 99% Material Safety Data Sheet
Synonym:Orotic acid methyl ester; Methyl 1,2,3,6-tetrahydro-2,6-dioxopyrimidine-4-carboxylat

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
6153-44-2 Methyl orotate 99 228-171-9
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:
May cause eye irritation.
Skin:
May cause skin irritation.
Ingestion:
May cause irritation of the digestive tract. The toxicological properties of this substance have not been fully investigated.
Inhalation:
May cause respiratory tract irritation. The toxicological properties of this substance have not been fully investigated.
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.
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.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or appropriate foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Sweep up, then place into a suitable container for disposal. Avoid generating dusty conditions. Provide ventilation.

Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use with adequate ventilation. Minimize dust generation and accumulation. Avoid contact with eyes, skin, and clothing. 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# 6153-44-2: 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:
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: Powder
Color: yellow
Odor: None reported.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 244 deg C
Autoignition Temperature: Not applicable.
Flash Point: Not applicable.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature: > 244 deg C
Solubility in water: Not available.
Specific Gravity/Density: Not available.
Molecular Formula: C6H6N2O4
Molecular Weight: 170.12

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, strong oxidants.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, irritating and toxic fumes and gases, carbon dioxide, nitrogen.
Hazardous Polymerization: Will not occur.

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 6153-44-2 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Methyl orotate - 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# 6153-44-2: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 6153-44-2 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 6153-44-2 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 Xi
Risk Phrases R36/37/38
Safety Phrases S26-S37-S39
HS Code 2933599090

 Synthetic Route

~92%

Methyl orotate Structure

Methyl orotate

CAS#:6153-44-2

Literature: Hudson, Robert H. E.; Wojciechowski, Filip Canadian Journal of Chemistry, 2005 , vol. 83, # 10 p. 1731 - 1740

~84%

Methyl orotate Structure

Methyl orotate

CAS#:6153-44-2

Literature: DeFrees, Shawn A.; Reddy, Kalakota S.; Cassady, John M. Synthetic Communications, 1988 , vol. 18, # 2 p. 213 - 220

~%

Methyl orotate Structure

Methyl orotate

CAS#:6153-44-2

Literature: Heterocycles, , vol. 67, # 1 p. 135 - 160

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Methyl orotate Structure

Methyl orotate

CAS#:6153-44-2

Literature: American Chemical Journal, , vol. 38, p. 362

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Methyl orotate Structure

Methyl orotate

CAS#:6153-44-2

Literature: Bulletin des Societes Chimiques Belges, , vol. 62, p. 611,617

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Methyl orotate Structure

Methyl orotate

CAS#:6153-44-2

Literature: Biochimica et Biophysica Acta, , vol. 23, p. 295,303

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Methyl orotate Structure

Methyl orotate

CAS#:6153-44-2

Literature: Heterocycles, , vol. 67, # 1 p. 135 - 160

 Customs

HS Code 2933599090
Summary 2933599090. other compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

4-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-2,6-dioxo-, methyl ester
Methyl 2,6-dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylate
methyl 2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylate
EINECS 228-171-9
methyl 2,4-dioxo-1H-pyrimidine-6-carboxylate
MFCD00010564
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