7,7-dichlorobicyclo(3.2.0)hept-2-en-6-one

Modify Date: 2024-01-05 10:30:36

7,7-dichlorobicyclo(3.2.0)hept-2-en-6-one Structure
7,7-dichlorobicyclo(3.2.0)hept-2-en-6-one structure
Common Name 7,7-dichlorobicyclo(3.2.0)hept-2-en-6-one
CAS Number 5307-99-3 Molecular Weight 177.028
Density 1.4±0.1 g/cm3 Boiling Point 274.8±35.0 °C at 760 mmHg
Molecular Formula C7H6Cl2O Melting Point N/A
MSDS N/A Flash Point 114.1±26.5 °C

 Names

Name 7,7-dichlorobicyclo[3.2.0]hept-2-en-6-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.4±0.1 g/cm3
Boiling Point 274.8±35.0 °C at 760 mmHg
Molecular Formula C7H6Cl2O
Molecular Weight 177.028
Flash Point 114.1±26.5 °C
Exact Mass 175.979568
PSA 17.07000
LogP 0.56
Vapour Pressure 0.0±0.6 mmHg at 25°C
Index of Refraction 1.569
Storage condition Refrigerator (+4°C)

 MSDS

Name: 7 7-Dichlorobicyclo(3.2.0)hept-2-enone Material Safety Data Sheet
Synonym: None
CAS: 5307-99-3
Section 1 - Chemical Product MSDS Name:7 7-Dichlorobicyclo(3.2.0)hept-2-enone Material Safety Data Sheet
Synonym:None

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
5307-99-3 7,7-Dichlorobicyclo(3.2.0)hept-2-enone 98 226-165-0
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:
No information found.

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:
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:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable container. Provide ventilation.

Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use with adequate ventilation. Avoid contact with eyes, skin, and clothing. Avoid breathing vapor or mist.
Storage:
Store in a tightly closed container. Store in a dry area. Keep refrigerated. (Store below 4C/39F.)

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# 5307-99-3: Personal Protective Equipment Eyes: Wear chemical splash 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. 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: clear brown
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 127 - 129 deg C @ 25 mmHg
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: C7H6Cl2O
Molecular Weight: 177.03

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
High temperatures.
Incompatibilities with Other Materials:
Strong bases, strong oxidizing agents, strong reducing agents.
Hazardous Decomposition Products:
Hydrogen chloride, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 5307-99-3 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
7,7-Dichlorobicyclo(3.2.0)hept-2-enone - 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: Not regulated.
Hazard Class:
UN Number:
Packing Group:
IMO
Shipping Name: Not regulated.
Hazard Class:
UN Number:
Packing Group:
RID/ADR
Shipping Name: Not regulated.
Hazard Class:
UN Number:
Packing group:

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# 5307-99-3: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 5307-99-3 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 5307-99-3 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-S36/37/39
HS Code 2914700090

 Synthetic Route

~88%

7,7-dichlorobicyclo(3.2.0)hept-2-en-6-one Structure

7,7-dichlorobic...

CAS#:5307-99-3

Literature: Baya, Mounir; Soulounganga, Patrice; Gelhaye, Eric; Grardin, Philippe Pest Management Science, 2001 , vol. 57, # 9 p. 833 - 838

~62%

7,7-dichlorobicyclo(3.2.0)hept-2-en-6-one Structure

7,7-dichlorobic...

CAS#:5307-99-3

Literature: Ussing, Bryson R.; Hang, Chao; Singleton, Daniel A. Journal of the American Chemical Society, 2006 , vol. 128, # 23 p. 7594 - 7607

~86%

7,7-dichlorobicyclo(3.2.0)hept-2-en-6-one Structure

7,7-dichlorobic...

CAS#:5307-99-3

Literature: Depres; Greene; Crabbe Tetrahedron, 1981 , vol. 37, # 3 p. 621 - 628

~36%

7,7-dichlorobicyclo(3.2.0)hept-2-en-6-one Structure

7,7-dichlorobic...

CAS#:5307-99-3

Literature: Fleming, Ian; Williams, Richard Vaughan Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1981 , p. 684 - 688

~30%

7,7-dichlorobicyclo(3.2.0)hept-2-en-6-one Structure

7,7-dichlorobic...

CAS#:5307-99-3

Detail
Literature: Tetrahedron Letters, , p. 3489 - 3490 J, Organometal. Chem., , vol. 42, p. 117 - 121

~%

7,7-dichlorobicyclo(3.2.0)hept-2-en-6-one Structure

7,7-dichlorobic...

CAS#:5307-99-3

Literature: Journal of Organometallic Chemistry, , vol. 42, p. 117 - 121

 Customs

HS Code 2914700090
Summary HS: 2914700090 halogenated, sulphonated, nitrated or nitrosated derivatives of ketones and quinones, whether or not with other oxygen function Tax rebate rate:9.0% Supervision conditions:none VAT:17.0% MFN tariff:5.5% General tariff:30.0%

 Synonyms

EINECS 226-165-0
MFCD00013738
7,7-dichlorobicyclo(3.2.0)hept-2-en-6-one
Bicyclo[3.2.0]hept-2-en-6-one, 7,7-dichloro-
7,7-DICHLOROBICYCLO[3.2.0]HEPT-2-EN-6-ONE
6,6-dichlorobicyclo[3.2.0]hept-3-en-7-one
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