(R)-3-Benzyl-4-methoxy-4-oxobutanoic acid

Modify Date: 2024-01-10 17:48:00

(R)-3-Benzyl-4-methoxy-4-oxobutanoic acid Structure
(R)-3-Benzyl-4-methoxy-4-oxobutanoic acid structure
Common Name (R)-3-Benzyl-4-methoxy-4-oxobutanoic acid
CAS Number 119807-84-0 Molecular Weight 222.23700
Density 1.19g/cm3 Boiling Point 364.728ºC at 760 mmHg
Molecular Formula C12H14O4 Melting Point N/A
MSDS N/A Flash Point 138.768ºC

 Names

Name (R)-3-Benzyl-4-methoxy-4-oxobutanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.19g/cm3
Boiling Point 364.728ºC at 760 mmHg
Molecular Formula C12H14O4
Molecular Weight 222.23700
Flash Point 138.768ºC
Exact Mass 222.08900
PSA 63.60000
LogP 1.49300
Vapour Pressure 0mmHg at 25°C
Index of Refraction 1.529

 MSDS

Name: (R)-2-Benzylsuccinic acid-1-methyl ester 95% (98% E.E.) Material Safety Data Sheet
Synonym: (R)-3-Methoxycarbonyl-4-phenylbutyric acid
CAS: 119807-84-0
Section 1 - Chemical Product MSDS Name:(R)-2-Benzylsuccinic acid-1-methyl ester 95% (98% E.E.) Material Safety Data Sheet
Synonym:(R)-3-Methoxycarbonyl-4-phenylbutyric acid

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
119807-84-0 (R)-2-Benzylsuccinic acid-1-methyl est 95 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:
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: 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. Vapors may be heavier than air. They can spread along the ground and collect in low or confined areas. Runoff from fire control or dilution water may cause pollution.
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:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable container. Avoid runoff into storm sewers and ditches which lead to waterways. Clean up spills immediately, observing precautions in the Protective Equipment section. Provide ventilation.

Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Use with adequate ventilation. Avoid breathing dust, vapor, mist, or gas. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation.
Storage:
Store in a tightly closed container. Store in a dry area. Keep refrigerated. (Store below 4C/39F.)

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# 119807-84-0: Personal Protective Equipment Eyes: Wear chemical splash goggles.
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: Viscous liquid
Color: yellow
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: Not available.
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: C12H14O4
Molecular Weight: 222.24

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not currently available.
Conditions to Avoid:
Incompatible materials, excess heat.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 119807-84-0 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
(R)-2-Benzylsuccinic acid-1-methyl ester - 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# 119807-84-0: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 119807-84-0 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 119807-84-0 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
Packaging Group III

 Synthetic Route

~58%

(R)-3-Benzyl-4-methoxy-4-oxobutanoic acid Structure

(R)-3-Benzyl-4-...

CAS#:119807-84-0

Literature: EUROSCREEN S.A.; HOVEYDA, Hamid; BRANTIS, Cyrille Evangelos; DUTHEUIL, Guillaume; ZOUTE, Ludivine; SCHILS, Didier; BERNARD, Jerome Patent: WO2010/66682 A1, 2010 ; Location in patent: Page/Page column 207 ; WO 2010/066682 A1

 Synonyms

MFCD00211258
(R)-2-Benzylsuccinic acid-1-methyl ester
(R)-(+)-2-Benzylsuccinic acid 1-methyl ester