Furfuryl isothiocyanate

Modify Date: 2024-01-02 17:22:24

Furfuryl isothiocyanate Structure
Furfuryl isothiocyanate structure
Common Name Furfuryl isothiocyanate
CAS Number 4650-60-6 Molecular Weight 139.17500
Density 1.39 Boiling Point 64 °C
Molecular Formula C6H5NOS Melting Point N/A
MSDS Chinese USA Flash Point 64-68°C/2mm

 Names

Name 2-furfuryl isothiocyanate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.39
Boiling Point 64 °C
Molecular Formula C6H5NOS
Molecular Weight 139.17500
Flash Point 64-68°C/2mm
Exact Mass 139.00900
PSA 57.59000
LogP 1.88240
Index of Refraction 1.5655

 MSDS

Name: 2-Furylmethyl isothiocyanate 95+% Material Safety Data Sheet
Synonym: 2-Furfuryl isothiocyanat
CAS: 4650-60-6
Section 1 - Chemical Product MSDS Name:2-Furylmethyl isothiocyanate 95+% Material Safety Data Sheet
Synonym:2-Furfuryl isothiocyanat

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
4650-60-6 2-Furylmethyl isothiocyanate 95+% 225-079-0
Hazard Symbols: XN
Risk Phrases: 20/21/22 36/37/38

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Harmful by inhalation, in contact with skin and if swallowed.
Irritating to eyes, respiratory system and skin.Moisture sensitive.
Potential Health Effects
Eye:
Causes eye irritation. Lachrymator (substance which increases the flow of tears).
Skin:
Causes skin irritation. Harmful if absorbed through the skin.
Ingestion:
Harmful if swallowed. May cause irritation of the digestive tract.
Inhalation:
Harmful if inhaled. Causes respiratory tract irritation.
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. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:

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 foam, dry chemical, or carbon dioxide.

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. Use only in a chemical fume hood.
Storage:
Store in a cool, dry place. Store in a tightly closed container.
Store under an inert atmosphere.

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# 4650-60-6: 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: orange - dark brown
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 64 - 68 deg C @2mmHg
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: 1.39
Molecular Formula: C6H5NOS
Molecular Weight: 139

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials, exposure to moist air or water.
Incompatibilities with Other Materials:
Strong oxidizing agents, acids, bases.
Hazardous Decomposition Products:
Carbon monoxide, oxides of nitrogen, oxides of sulfur, carbon dioxide, acrid smoke and fumes.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 4650-60-6 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
2-Furylmethyl isothiocyanate - 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
Shipping Name: TOXIC LIQUID, ORGANIC, N.O.S.*
Hazard Class: 6.1
UN Number: 2810
Packing Group: III
IMO
Shipping Name: TOXIC LIQUID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2810
Packing Group: III
RID/ADR
Shipping Name: TOXIC LIQUID, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2810
Packing group: III

Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XN
Risk Phrases:
R 20/21/22 Harmful by inhalation, in contact with
skin and if swallowed.
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 36/37/39 Wear suitable protective clothing, gloves
and eye/face protection.
WGK (Water Danger/Protection)
CAS# 4650-60-6: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 4650-60-6 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 4650-60-6 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 Xn:Harmful;
Risk Phrases R20/21/22;R36/37/38
Safety Phrases S26-S36/37/39
RIDADR 2810
Packaging Group III
Hazard Class 8
HS Code 2932190090

 Synthetic Route

~69%

Furfuryl isothiocyanate Structure

Furfuryl isothi...

CAS#:4650-60-6

Literature: Nath, Jayashree; Ghosh, Harisadhan; Yella, Mamesh; Patel, Bhisma K. European Journal of Organic Chemistry, 2009 , # 12 p. 1849 - 1851

~94%

Furfuryl isothiocyanate Structure

Furfuryl isothi...

CAS#:4650-60-6

Literature: Li, Zheng-Yi; Ma, Hong-Zhao; Han, Chen; Xi, Hai-Tao; Meng, Qi; Chen, Xin; Sun, Xiao-Qiang Synthesis (Germany), 2013 , vol. 45, # 12 art. no. SS-2013-F0228-OP, p. 1667 - 1674

~%

Furfuryl isothiocyanate Structure

Furfuryl isothi...

CAS#:4650-60-6

Literature: American Cyanamid Company Patent: US4267191 A1, 1981 ; Title/Abstract Full Text Show Details American Cyanamid Company Patent: US4313885 A1, 1982 ;

~82%

Furfuryl isothiocyanate Structure

Furfuryl isothi...

CAS#:4650-60-6

Literature: Li, Zheng-Yi; Ma, Hong-Zhao; Han, Chen; Xi, Hai-Tao; Meng, Qi; Chen, Xin; Sun, Xiao-Qiang Synthesis (Germany), 2013 , vol. 45, # 12 art. no. SS-2013-F0228-OP, p. 1667 - 1674

~%

Furfuryl isothiocyanate Structure

Furfuryl isothi...

CAS#:4650-60-6

Literature: Muccioli, Giulio G.; Martin, Diana; Scriba, Gerhard K. E.; Poppitz, Wolfgang; Poupaert, Jacques H.; Wouters, Johan; Lambert, Didier M. Journal of Medicinal Chemistry, 2005 , vol. 48, # 7 p. 2509 - 2517

~%

Furfuryl isothiocyanate Structure

Furfuryl isothi...

CAS#:4650-60-6

Literature: Li, Zheng-Yi; Ma, Hong-Zhao; Han, Chen; Xi, Hai-Tao; Meng, Qi; Chen, Xin; Sun, Xiao-Qiang Synthesis (Germany), 2013 , vol. 45, # 12 art. no. SS-2013-F0228-OP, p. 1667 - 1674

 Customs

HS Code 2932190090
Summary 2932190090 other compounds containing an unfused furan ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%

 Synonyms

2-Furfurylisothiocyanate
2-furanylmethyl isothiocyanate
Furfurylisothiocyanate
2-FURYLMETHYL ISOTHIOCYANATE
EINECS 225-079-0
Furfuryl isothiocyanate
MFCD00014112
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