3-N-Boc-Amino-3-(4-methoxyphenyl)propionic acid

Modify Date: 2024-01-04 18:33:04

3-N-Boc-Amino-3-(4-methoxyphenyl)propionic acid Structure
3-N-Boc-Amino-3-(4-methoxyphenyl)propionic acid structure
Common Name 3-N-Boc-Amino-3-(4-methoxyphenyl)propionic acid
CAS Number 96363-20-1 Molecular Weight 295.331
Density 1.2±0.1 g/cm3 Boiling Point 463.2±45.0 °C at 760 mmHg
Molecular Formula C15H21NO5 Melting Point 167-169ºC (dec.)
MSDS N/A Flash Point 233.9±28.7 °C

 Names

Name 3-(4-methoxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 463.2±45.0 °C at 760 mmHg
Melting Point 167-169ºC (dec.)
Molecular Formula C15H21NO5
Molecular Weight 295.331
Flash Point 233.9±28.7 °C
Exact Mass 295.141968
PSA 84.86000
LogP 2.63
Vapour Pressure 0.0±1.2 mmHg at 25°C
Index of Refraction 1.522
Storage condition Freezer (-20°C)

 MSDS

Name: 3-N-BOC-AMINO-3(4-METHOXYPHENYL)PROPIONIC ACID Material Safety Data Sheet
Synonym: 3-N-(TERT-BUTOXYCARBONYL)-AMINO-3-(4-METHOXYPHENYL)PROPIONIC ACI
CAS: 96363-20-1
Section 1 - Chemical Product MSDS Name:3-N-BOC-AMINO-3(4-METHOXYPHENYL)PROPIONIC ACID Material Safety Data Sheet
Synonym:3-N-(TERT-BUTOXYCARBONYL)-AMINO-3-(4-METHOXYPHENYL)PROPIONIC ACI

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
96363-20-1 3-N-BOC-AMINO-3(4-METHOXYPHENYL)PROPIO ca100 unlisted
| |NIC ACID | |
Hazard Symbols: XI
Risk Phrases: 36/37/38

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin.
Potential Health Effects
Eye:
Causes eye irritation.
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:
Effects may be delayed.

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 soap and water for at least 15 minutes while removing contaminated clothing and shoes. Wash clothing before reuse.
Ingestion:
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 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 appropriate foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Clean up spills immediately, observing precautions in the Protective Equipment section. Sweep up or absorb material, then place into a suitable clean, dry, closed container for disposal. Avoid generating dusty conditions. Provide ventilation.

Section 7 - HANDLING and STORAGE
Handling:
Minimize dust generation and accumulation. 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 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.
Personal Protective Equipment Eyes: Wear chemical 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. Always use a NIOSH or European Standard EN 149 approved respirator when necessary.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Solid
Color: white
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: C15H21NO5
Molecular Weight: 295.1507

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not available.
Conditions to Avoid:
Not available.
Incompatibilities with Other Materials:
Not available.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Not available.

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 96363-20-1 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
3-N-BOC-AMINO-3(4-METHOXYPHENYL)PROPIONIC ACID - Not listed by ACGIH, IARC, NIOSH, NTP, or OSHA.
See actual entry in RTECS for complete information.

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: 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# 96363-20-1: No information available.
United Kingdom Occupational Exposure Limits
United Kingdom Maximum Exposure Limits
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 96363-20-1 is not listed on Canada's Ingredient Disclosure List.
Exposure Limits
US FEDERAL
TSCA
CAS# 96363-20-1 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:Irritant;
Risk Phrases R36/37/38
Safety Phrases S26-S37/39
HS Code 2922509090

 Customs

HS Code 2922509090
Summary 2922509090. other amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Synonyms

3-[(tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid
3-tert-Butoxycarbonylamino-3-(4-methoxy-phenyl)-propionic acid
MFCD02090694
Benzenepropanoic acid, β-[[(1,1-dimethylethoxy)carbonyl]amino]-4-methoxy-
3-(4-Methoxyphenyl)-3-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)propanoic acid
3-(Boc-amino)-3-(4-methoxyphenyl)propionic acid
D,L-3-{[(1,1-dimethylethoxy)carbonyl]amino}-3-(4-methoxyphenyl)propanoic acid
Boc-3-Amino-3-(4-methoxyphenyl)propionic acid