5-(Chloromethyl)-1,3-benzodioxole

Modify Date: 2024-01-03 17:12:48

5-(Chloromethyl)-1,3-benzodioxole Structure
5-(Chloromethyl)-1,3-benzodioxole structure
Common Name 5-(Chloromethyl)-1,3-benzodioxole
CAS Number 20850-43-5 Molecular Weight 170.593
Density 1.3±0.1 g/cm3 Boiling Point 257.4±9.0 °C at 760 mmHg
Molecular Formula C8H7ClO2 Melting Point 20.5ºC
MSDS N/A Flash Point 115.9±13.9 °C

 Names

Name 3,4-Methylenedioxybenzyl chloride
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 257.4±9.0 °C at 760 mmHg
Melting Point 20.5ºC
Molecular Formula C8H7ClO2
Molecular Weight 170.593
Flash Point 115.9±13.9 °C
Exact Mass 170.013458
PSA 18.46000
LogP 2.35
Vapour Pressure 0.0±0.5 mmHg at 25°C
Index of Refraction 1.571

 MSDS

Name: 5-(Chloromethyl)-1 3-benzodioxole 90+% Material Safety Data Sheet
Synonym: 1,3-Benzodioxole, 5-(chloromethyl)-
CAS: 20850-43-5
Section 1 - Chemical Product MSDS Name:5-(Chloromethyl)-1 3-benzodioxole 90+% Material Safety Data Sheet
Synonym:1,3-Benzodioxole, 5-(chloromethyl)-

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
20850-43-5 5-(Chloromethyl)-1,3-benzodioxole 90+% 244-081-2
Hazard Symbols: C
Risk Phrases: 34

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Causes burns.
Potential Health Effects
Eye:
Causes eye burns.
Skin:
Causes skin burns.
Ingestion:
Causes gastrointestinal tract burns.
Inhalation:
Causes chemical burns to the respiratory tract.
Chronic:
Chronic exposure may cause effects similar to those of acute exposure.

Section 4 - FIRST AID MEASURES
Eyes: Immediately flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid immediately. Do NOT allow victim to rub eyes or keep eyes closed.
Skin:
Get medical aid immediately. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
If swallowed, do NOT induce vomiting. Get medical aid immediately.
If victim is fully conscious, give a cupful of water. Never give anything by mouth to an unconscious person.
Inhalation:
Get medical aid immediately. Remove from exposure and move to fresh air immediately. If breathing is difficult, give oxygen. Do NOT use mouth-to-mouth resuscitation. If breathing has ceased apply artificial respiration using oxygen and a suitable mechanical device such as a bag and a mask.
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. Vapors may be heavier than air. They can spread along the ground and collect in low or confined areas. Runoff from fire control or dilution water may cause pollution.
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. Avoid runoff into storm sewers and ditches which lead to waterways. Clean up spills immediately, observing precautions in the Protective Equipment section. Provide ventilation.

Section 7 - HANDLING and STORAGE
Handling:
Do not breathe dust, vapor, mist, or gas. Do not get in eyes, on skin, or on clothing. Keep container tightly closed. Do not ingest or inhale. Use only in a chemical fume hood. Discard contaminated shoes.
Storage:
Store in a cool, dry place. Store in a tightly closed container.
Corrosives area. 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# 20850-43-5: 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: Liquid
Color: colorless
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 67 - 68 deg C @0.05mmHg
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: C8H7ClO2
Molecular Weight: 170.59

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not currently available.
Conditions to Avoid:
None reported.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Hydrogen chloride, chlorine, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 20850-43-5 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
5-(Chloromethyl)-1,3-benzodioxole - Not listed by ACGIH, IARC, or NTP.

Section 12 - ECOLOGICAL INFORMATION
Ecotoxicity:
Fish: Pseudomonas putida:

Section 13 - DISPOSAL CONSIDERATIONS
Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION

IATA
Shipping Name: CORROSIVE LIQUID, ACIDIC, ORGANIC, N.O.S.*
Hazard Class: 8
UN Number: 3265
Packing Group: III
IMO
Shipping Name: CORROSIVE LIQUID, ACIDIC, ORGANIC, N.O.S.
Hazard Class: 8
UN Number: 3265
Packing Group: III
RID/ADR
Shipping Name: CORROSIVE LIQUID, ACIDIC, ORGANIC, N.O.S.
Hazard Class: 8
UN Number: 3265
Packing group: III

Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: C
Risk Phrases:
R 34 Causes burns.
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.
S 45 In case of accident or if you feel unwell, seek
medical advice immediately (show the label where
possible).
WGK (Water Danger/Protection)
CAS# 20850-43-5: No information available.
Canada
CAS# 20850-43-5 is listed on Canada's NDSL List.
CAS# 20850-43-5 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 20850-43-5 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Safety Information

Hazard Codes Xi: Irritant;
Risk Phrases R36/37/38
Safety Phrases S26-S36/37/39-S45
HS Code 2932999099

 Synthetic Route

~99%

5-(Chloromethyl)-1,3-benzodioxole Structure

5-(Chloromethyl...

CAS#:20850-43-5

Literature: KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY; JEIL PHARM. CO., LTD.; KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY; CJ CORP. Patent: WO2005/100303 A1, 2005 ; Location in patent: Page/Page column 42 ; WO 2005/100303 A1

~50%

5-(Chloromethyl)-1,3-benzodioxole Structure

5-(Chloromethyl...

CAS#:20850-43-5

Literature: ENDURA S.P.A. Patent: WO2005/42512 A1, 2005 ; Location in patent: Page/Page column 8 ;

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5-(Chloromethyl)-1,3-benzodioxole Structure

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CAS#:20850-43-5

Literature: WO2005/42512 A1, ; Page/Page column 8-9 ;

~%

5-(Chloromethyl)-1,3-benzodioxole Structure

5-(Chloromethyl...

CAS#:20850-43-5

Literature: Chemische Berichte, , vol. 38, p. 1741

~%

5-(Chloromethyl)-1,3-benzodioxole Structure

5-(Chloromethyl...

CAS#:20850-43-5

Literature: Zhurnal Obshchei Khimii, , vol. 8, p. 975,978 Chem. Zentralbl., , vol. 110, # I p. 2178

~%

5-(Chloromethyl)-1,3-benzodioxole Structure

5-(Chloromethyl...

CAS#:20850-43-5

Literature: Zhurnal Obshchei Khimii, , vol. 8, p. 975,978 Chem. Zentralbl., , vol. 110, # I p. 2178

~%

5-(Chloromethyl)-1,3-benzodioxole Structure

5-(Chloromethyl...

CAS#:20850-43-5

Literature: Chemische Berichte, , vol. 38, p. 1741

~%

5-(Chloromethyl)-1,3-benzodioxole Structure

5-(Chloromethyl...

CAS#:20850-43-5

Literature: Bulletin de la Societe Chimique de France, , vol. <5> 2, p. 291,294

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Detail
Literature: Zhurnal Obshchei Khimii, , vol. 8, p. 975,978 Chem. Zentralbl., , vol. 110, # I p. 2178

 Customs

HS Code 2932999099
Summary 2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

1,3-Benzodioxole, 5- (chloromethyl)-
1,3-Benzodioxole, 5-(chloromethyl)-
3,4-(Methylenedioxy)benzyl chloride
Toluene, α-chloro-3,4-(methylenedioxy)-
4-Chloromethyl-1,2-methylenedioxybenzene
5-(Chloromethyl)-1,3-benzodioxole
MFCD00044328
EINECS 244-081-2