(2Z)-2-benzylidenebutanoic acid

Modify Date: 2024-01-10 10:05:15

(2Z)-2-benzylidenebutanoic acid Structure
(2Z)-2-benzylidenebutanoic acid structure
Common Name (2Z)-2-benzylidenebutanoic acid
CAS Number 620-78-0 Molecular Weight 176.21200
Density 1.116g/cm3 Boiling Point 302.7ºC at 760 mmHg
Molecular Formula C11H12O2 Melting Point N/A
MSDS N/A Flash Point 208.1ºC

 Names

Name (2Z)-2-benzylidenebutanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.116g/cm3
Boiling Point 302.7ºC at 760 mmHg
Molecular Formula C11H12O2
Molecular Weight 176.21200
Flash Point 208.1ºC
Exact Mass 176.08400
PSA 37.30000
LogP 2.56460
Index of Refraction 1.583

 MSDS


Section1. IDENTIFICATION OF THE SUBSTANCE/MIXTURE
Product identifiers
Product name: Alpha-ethylcinnamic acid
CAS-No.: 620-78-0
Relevant identified uses of the substance or mixture and uses advised against
Identified uses: Laboratory chemicals, Manufacture of substances



Section2. HAZARDS IDENTIFICATION
Classification of the substance or mixture
Classification according to Regulation (EC) No 1272/2008 [EU-GHS/CLP]
Eye irritation (Category 2)
This substance is not classified as dangerous according to Directive 67/548/EEC.
Label elements
Labelling according Regulation (EC) No 1272/2008 [CLP]
Pictogram
Signal wordWarning
Hazard statement(s)
H319Causes serious eye irritation.
Precautionary statement(s)
P305 + P351 + P338IF IN EYES: Rinse cautiously with water for several minutes. Remove
contact lenses, if present and easy to do. Continue rinsing.
Supplemental Hazardnone
Statements
Other hazards - none

Section3. COMPOSITION/INFORMATION ON INGREDIENTS
Substances
Formula: C11H12O2
Molecular Weight: 176,22 g/mol

Section4. FIRST AID MEASURES
Description of first aid measures
General advice
Consult a physician. Show this safety data sheet to the doctor in attendance.
If inhaled
If breathed in, move person into fresh air. If not breathing, give artificial respiration. Consult a physician.
In case of skin contact
Wash off with soap and plenty of water. Consult a physician.
In case of eye contact
Rinse thoroughly with plenty of water for at least 15 minutes and consult a physician.
If swallowed
Never give anything by mouth to an unconscious person. Rinse mouth with water. Consult a physician.
Most important symptoms and effects, both acute and delayed
To the best of our knowledge, the chemical, physical, and toxicological properties have not been
thoroughly investigated.
Indication of any immediate medical attention and special treatment needed
no data available

Section5. FIREFIGHTING MEASURES
Extinguishing media
Suitable extinguishing media
Use water spray, alcohol-resistant foam, dry chemical or carbon dioxide.
Special hazards arising from the substance or mixture
Carbon oxides
Advice for firefighters
Wear self contained breathing apparatus for fire fighting if necessary.
Further information
no data available

Section6. ACCIDENTAL RELEASE MEASURES
Personal precautions, protective equipment and emergency procedures
Use personal protective equipment. Avoid dust formation. Avoid breathing vapors, mist or gas. Ensure
adequate ventilation. Avoid breathing dust.
Environmental precautions
Do not let product enter drains.
Methods and materials for containment and cleaning up
Pick up and arrange disposal without creating dust. Sweep up and shovel. Keep in suitable, closed
containers for disposal.
Reference to other sections
For disposal see section 13.

Section7. HANDLING AND STORAGE
Precautions for safe handling
Avoid contact with skin and eyes. Avoid formation of dust and aerosols.
Provide appropriate exhaust ventilation at places where dust is formed.Normal measures for preventive fire
protection.
Conditions for safe storage, including any incompatibilities
Store in cool place. Keep container tightly closed in a dry and well-ventilated place.
Specific end uses
no data available

Section8. EXPOSURE CONTROLS/PERSONAL PROTECTION
Control parameters
Components with workplace control parameters
Exposure controls
Appropriate engineering controls
Handle in accordance with good industrial hygiene and safety practice. Wash hands before breaks and
at the end of workday.
Personal protective equipment
Eye/face protection
Safety glasses with side-shields conforming to EN166 Use equipment for eye protection tested
and approved under appropriate government standards such as NIOSH (US) or EN 166(EU).
Skin protection
Handle with gloves. Gloves must be inspected prior to use. Use proper glove removal technique
(without touching glove's outer surface) to avoid skin contact with this product. Dispose of
contaminated gloves after use in accordance with applicable laws and good laboratory practices.
Wash and dry hands.
The selected protective gloves have to satisfy the specifications of EU Directive 89/686/EEC and
the standard EN 374 derived from it.
Body Protection
impervious clothing, The type of protective equipment must be selected according to the
concentration and amount of the dangerous substance at the specific workplace.
Respiratory protection
For nuisance exposures use type P95 (US) or type P1 (EU EN 143) particle respirator.For higher
level protection use type OV/AG/P99 (US) or type ABEK-P2 (EU EN 143) respirator cartridges.
Use respirators and components tested and approved under appropriate government standards
such as NIOSH (US) or CEN (EU).

Section9. PHYSICAL AND CHEMICAL PROPERTIES
Information on basic physical and chemical properties
a) AppearanceForm: solid
b) Odourno data available
c) Odour Thresholdno data available
d) pHno data available
e) Melting point/freezingno data available
point
f) Initial boiling point and no data available
boiling range
g) Flash pointno data available
h) Evaporation rateno data available
i) Flammability (solid, gas) no data available
j) Upper/lowerno data available
flammability or
explosive limits
k) Vapour pressureno data available
l) Vapour densityno data available
m) Relative densityno data available
n) Water solubilityno data available
o) Partition coefficient: n- log Pow: 2,773
octanol/water
p) Autoignitionno data available
temperature
q) Decompositionno data available
temperature
r) Viscosityno data available
s) Explosive propertiesno data available
t) Oxidizing propertiesno data available
Other safety information
no data available

Section10. STABILITY AND REACTIVITY
Reactivity
no data available
Chemical stability
no data available
Possibility of hazardous reactions
no data available
Conditions to avoid
no data available
Incompatible materials
Strong oxidizing agents
Hazardous decomposition products
Other decomposition products - no data available

Section11. TOXICOLOGICAL INFORMATION
Information on toxicological effects
Acute toxicity
no data available
Skin corrosion/irritation
no data available
Serious eye damage/eye irritation
no data available
Respiratory or skin sensitization
no data available
Germ cell mutagenicity
no data available
Carcinogenicity
IARC:No component of this product present at levels greater than or equal to 0.1% is identified as
probable, possible or confirmed human carcinogen by IARC.
Reproductive toxicity
no data available
Specific target organ toxicity - single exposure
no data available
Specific target organ toxicity - repeated exposure
no data available
Aspiration hazard
no data available
Potential health effects
InhalationMay be harmful if inhaled. May cause respiratory tract irritation.
IngestionMay be harmful if swallowed.
SkinMay be harmful if absorbed through skin. May cause skin irritation.
EyesCauses eye irritation.
Signs and Symptoms of Exposure
To the best of our knowledge, the chemical, physical, and toxicological properties have not been
thoroughly investigated.
Additional Information
RTECS: Not available

Section12. ECOLOGICAL INFORMATION
Toxicity
no data available
Persistence and degradability
no data available
Bioaccumulative potential
no data available
Mobility in soil
no data available
Results of PBT and vPvB assessment
no data available
Other adverse effects
no data available

Section13. DISPOSAL CONSIDERATIONS
Waste treatment methods
Product
Offer surplus and non-recyclable solutions to a licensed disposal company. Contact a licensed
professional waste disposal service to dispose of this material. Dissolve or mix the material with a
combustible solvent and burn in a chemical incinerator equipped with an afterburner and scrubber.
Contaminated packaging
Dispose of as unused product.

Section14. TRANSPORT INFORMATION
UN number
ADR/RID: -IMDG: -IATA: -
UN proper shipping name
ADR/RID: Not dangerous goods
IMDG: Not dangerous goods
IATA:Not dangerous goods
Transport hazard class(es)
ADR/RID: -IMDG: -IATA: -
Packaging group
ADR/RID: -IMDG: -IATA: -
Environmental hazards
ADR/RID: noIMDG Marine pollutant: noIATA: no
Special precautions for user
no data available



SECTION 15 - REGULATORY INFORMATION
N/A


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

HS Code 2916399090

 Synthetic Route

~63%

(2Z)-2-benzylidenebutanoic acid Structure

(2Z)-2-benzylid...

CAS#:620-78-0

Literature: Yamashita, Kohei; Chatani, Naoto Synlett, 2005 , # 6 art. no. U02105ST, p. 919 - 922

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(2Z)-2-benzylidenebutanoic acid Structure

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CAS#:620-78-0

Literature: Fittig Chemische Berichte, 1883 , vol. 16, p. 1437 Full Text Show Details Fittig; Slocum Justus Liebigs Annalen der Chemie, 1885 , vol. 227, p. 59 Full Text Show Details Perkin Journal of the Chemical Society, 1877 , vol. 31, p. 409 Journal of the Chemical Society, 1878 , vol. 33, p. 215

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(2Z)-2-benzylidenebutanoic acid Structure

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CAS#:620-78-0

Literature: Huang,R.L. et al. Journal of the Chemical Society, 1965 , p. 6730 - 6737

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(2Z)-2-benzylidenebutanoic acid Structure

(2Z)-2-benzylid...

CAS#:620-78-0

Literature: Newton,B.N. Journal of Medicinal Chemistry, 1976 , vol. 19, p. 1362 - 1366

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(2Z)-2-benzylidenebutanoic acid Structure

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CAS#:620-78-0

Detail
Literature: Fittig; Slocum Justus Liebigs Annalen der Chemie, 1885 , vol. 227, p. 59 Full Text Show Details Perkin Journal of the Chemical Society, 1877 , vol. 31, p. 409 Journal of the Chemical Society, 1878 , vol. 33, p. 215

~%

(2Z)-2-benzylidenebutanoic acid Structure

(2Z)-2-benzylid...

CAS#:620-78-0

Literature: Perkin Journal of the Chemical Society, 1877 , vol. 31, p. 409 Journal of the Chemical Society, 1878 , vol. 33, p. 215

~%

(2Z)-2-benzylidenebutanoic acid Structure

(2Z)-2-benzylid...

CAS#:620-78-0

Literature: Katoh Sci.Rep.Tokyo Bunrika Daigaku, 1935 , vol. 2, p. 260 Chem. Zentralbl., 1936 , vol. 107, # I p. 2324

~%

(2Z)-2-benzylidenebutanoic acid Structure

(2Z)-2-benzylid...

CAS#:620-78-0

Detail
Literature: Michael Journal fuer Praktische Chemie (Leipzig), 1899 , vol. <2> 60, p. 365 Chemische Berichte, 1901 , vol. 34, p. 919,927

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(2Z)-2-benzylidenebutanoic acid Structure

(2Z)-2-benzylid...

CAS#:620-78-0

Literature: Fichter Journal fuer Praktische Chemie (Leipzig), 1906 , vol. <2> 74, p. 338

 Customs

HS Code 2916399090
Summary 2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

2-Aethyl-3-phenyl-acrylsaeure
2-ethyl-3-phenyl-acrylic acid
ethyl 3-phenylpropenoic acid
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