91247-38-0

91247-38-0 structure
91247-38-0 structure
  • Name: DL-HOMOBENZYL-BETA-ALANINE
  • Chemical Name: 3-amino-5-phenyl-pentanoic acid
  • CAS Number: 91247-38-0
  • Molecular Formula: C11H15NO2
  • Molecular Weight: 193.242
  • Create Date: 2018-07-03 09:39:22
  • Modify Date: 2024-01-03 10:33:49

Name 3-amino-5-phenyl-pentanoic acid
Synonyms 3-amino-5-phenyl-valeric acid
3-Amino-5-phenyl-valeriansaeure
3-Amino-5-phenyl-pentanoic acid
3-Amino-5-phenylpentanoic acid
3-amino-5-phenyl-2-thiophenecarboxylic acid
MFCD01318914
Valeric acid,3-amino-5-phenyl-(+/-)-3-Amino-5-phenylpentanoic acid
5-phenyl-3-aminothiophene-2-carboxylic acid
Benzenepentanoic acid, β-amino-
2-Thiophenecarboxylic acid,3-amino-5-phenyl
Density 1.1±0.1 g/cm3
Boiling Point 368.2±42.0 °C at 760 mmHg
Melting Point 223-227ºC
Molecular Formula C11H15NO2
Molecular Weight 193.242
Flash Point 176.5±27.9 °C
Exact Mass 193.110275
PSA 63.32000
LogP 1.45
Vapour Pressure 0.0±0.9 mmHg at 25°C
Index of Refraction 1.556
Name: 3-Amino-5-phenylpentanoic acid 98% Material Safety Data Sheet
Synonym: None Known
CAS: 91247-38-0
Section 1 - Chemical Product MSDS Name:3-Amino-5-phenylpentanoic acid 98% Material Safety Data Sheet
Synonym:None Known

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
91247-38-0 3-Amino-5-phenylpentanoic acid 98% 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: In case of contact, immediately flush eyes with plenty of water for at least 15 minutes. Get medical aid.
Skin:
In case of contact, flush skin with plenty of water. Remove contaminated clothing and shoes. Get medical aid if irritation develops and persists. Wash clothing before reuse.
Ingestion:
If swallowed, do not induce vomiting unless directed to do so by medical personnel. Never give anything by mouth to an unconscious person. Get medical aid.
Inhalation:
If inhaled, remove to fresh air. 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 chemical foam.

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. Clean up spills immediately, observing precautions in the Protective Equipment section. Avoid generating dusty conditions.
Provide ventilation.

Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Use with adequate ventilation.
Minimize dust generation and accumulation. 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 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. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 91247-38-0: 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:
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: Flakes
Color: white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 223 - 227 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: soluble in water
Specific Gravity/Density:
Molecular Formula: C6H5(CH2)2CH(NH2)CH2COOH
Molecular Weight: 193.25

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions.
Conditions to Avoid:
Dust generation.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 91247-38-0 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
3-Amino-5-phenylpentanoic acid - 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# 91247-38-0: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 91247-38-0 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 91247-38-0 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A
Hazard Codes Xi
Safety Phrases S24/25
HS Code 2922499990

~90%

91247-38-0 structure

91247-38-0

Literature: Ashton, Michael J.; Hills, Susan J.; Newton, Christopher G.; Taylor, John B.; Tondu, Sylvie C. D. Heterocycles, 1989 , vol. 28, # 2 p. 1015 - 1035

~%

91247-38-0 structure

91247-38-0

Literature: Heterocycles, , vol. 28, # 2 p. 1015 - 1035

~%

91247-38-0 structure

91247-38-0

Literature: Heterocycles, , vol. 28, # 2 p. 1015 - 1035

~33%

91247-38-0 structure

91247-38-0

Literature: Lazar, Laszlo; Martinek, Tamas; Bernath, Gabor; Fueloep, Ferenc Synthetic Communications, 1998 , vol. 28, # 2 p. 219 - 224
Precursor  3

DownStream  0

HS Code 2922499990
Summary HS:2922499990 other amino-acids, other than those containing more than one kind of oxygen function, and their esters; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:6.5% General tariff:30.0%