80120-36-1

80120-36-1 structure
80120-36-1 structure
  • Name: ethyl 4-tert-butylbenzoylformate
  • Chemical Name: ethyl 2-(4-tert-butylphenyl)-2-oxoacetate
  • CAS Number: 80120-36-1
  • Molecular Formula: C14H18O3
  • Molecular Weight: 234.29100
  • Create Date: 2018-11-24 16:18:49
  • Modify Date: 2024-01-10 20:00:18

Name ethyl 2-(4-tert-butylphenyl)-2-oxoacetate
Synonyms Ethyl 4-tert-butylbenzoylformate
MFCD01934865
p-tert.-Butyl-phenylglyoxylsaeure-ethylester
Density 1.045g/cm3
Boiling Point 104-110/0.1mm
Molecular Formula C14H18O3
Molecular Weight 234.29100
Flash Point 139.4ºC
Exact Mass 234.12600
PSA 43.37000
LogP 2.72990
Index of Refraction 1.498
Name: Ethyl 2-[4-(tert-butyl)phenyl]-2-oxoacetate tech Material Safety Data Sheet
Synonym: Ethyl 2-(4-tert-butylphenyl)glyoxylat
CAS: 80120-36-1
Section 1 - Chemical Product MSDS Name:Ethyl 2-[4-(tert-butyl)phenyl]-2-oxoacetate tech Material Safety Data Sheet
Synonym:Ethyl 2-(4-tert-butylphenyl)glyoxylat

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
80120-36-1 Ethyl 2-[4-(tert-butyl)phenyl]-2-oxoac unlisted
Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Not available.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
May cause respiratory tract irritation. May be harmful if inhaled.
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.
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.
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.

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# 80120-36-1: 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: 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: C14H18O3
Molecular Weight: 234

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

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 80120-36-1 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Ethyl 2-[4-(tert-butyl)phenyl]-2-oxoacetate - 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
No information available.
IMO
No information available.
RID/ADR
No information available.

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# 80120-36-1: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 80120-36-1 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 80120-36-1 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A
Hazard Codes Xi
Risk Phrases R36/37/38
Safety Phrases 26-36/37/39
HS Code 2918300090

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Literature: SMITHKLINE BEECHAM CORPORATION Patent: WO2008/89052 A2, 2008 ; Location in patent: Page/Page column 42 ; WO 2008/089052 A2

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Literature: Song, Hongjian; Liu, Yuxiu; Xiong, Lixia; Li, Yongqiang; Yang, Na; Wang, Qingmin Journal of Agricultural and Food Chemistry, 2012 , vol. 60, # 6 p. 1470 - 1479

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80120-36-1

Literature: Organic Letters, , vol. 13, # 24 p. 6520 - 6523

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80120-36-1 structure

80120-36-1

Literature: Gassmann, J.; Guenther, H.; Osternack, K.; Sawluk, A.; Thimm, K.; Voss, J. Magnetic Resonance in Chemistry, 1994 , vol. 32, # 10 p. 624 - 630

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Literature: Angewandte Chemie - International Edition, , vol. 52, # 47 p. 122414 - 122417 Angew. Chem., , p. 12640 - 12643,4
HS Code 2918300090
Summary 2918300090 other carboxylic acids with aldehyde or ketone function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%