exo-3,6-epoxy-1,2,3,6-tetrahydrophthalic acid

Modify Date: 2024-01-02 07:34:59

exo-3,6-epoxy-1,2,3,6-tetrahydrophthalic acid Structure
exo-3,6-epoxy-1,2,3,6-tetrahydrophthalic acid structure
Common Name exo-3,6-epoxy-1,2,3,6-tetrahydrophthalic acid
CAS Number 28871-62-7 Molecular Weight 184.146
Density 1.6±0.1 g/cm3 Boiling Point 464.5±45.0 °C at 760 mmHg
Molecular Formula C8H8O5 Melting Point 129ºC
MSDS N/A Flash Point 199.1±22.2 °C

 Names

Name exo-3,6-epoxy-1,2,3,6-tetrahydrophthalic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.6±0.1 g/cm3
Boiling Point 464.5±45.0 °C at 760 mmHg
Melting Point 129ºC
Molecular Formula C8H8O5
Molecular Weight 184.146
Flash Point 199.1±22.2 °C
Exact Mass 184.037170
PSA 83.83000
LogP -0.38
Vapour Pressure 0.0±2.5 mmHg at 25°C
Index of Refraction 1.602

 MSDS


Section I.Chemical Product and Company Identification
Chemical Name exo-3,6-Epoxy-1,2,3,6-tetrahydrophthalic Acid
Portland OR
7-Oxabicyclo[2.2.1]hept-5-ene-2,3-
Synonym
dicarboxylic acid, (1R,2S,3R,4S)-rel- (9CI)
C8H8O5
Chemical Formula
CAS Number28871-62-7

Section II.Composition and Information on Ingredients
Chemical NameCAS Number Percent (%)TLV/PELToxicology Data
exo-3,6-Epoxy-1,2,3,6-tetrahydrophthalic Acid28871-62-7 Min. 98.0 (T) Not available.Mouse LD50 (intraperitoneal) 55
mg/kg

Section III. Hazards Identification
Acute Health EffectsNo specific information is available in our data base regarding the toxic effects of this material for humans. However,
exposure to any chemical should be kept to a minimum. Skin and eye contact may result in irritation. May be harmful if
inhaled or ingested. Always follow safe industrial hygiene practices and wear proper protective equipment when handling
this compound.
Follow safe industrial hygiene practices and always wear proper protective equipment when handling this compound.
Chronic Health EffectsCARCINOGENIC EFFECTS : Not available.
MUTAGENIC EFFECTS : Not available.
TERATOGENIC EFFECTS : Not available.
DEVELOPMENTAL TOXICITY: Not available.
Repeated or prolonged exposure to this compound is not known to aggravate existing medical conditions.

Section IV.First Aid Measures
Eye ContactCheck for and remove any contact lenses. In case of contact, immediately flush eyes with plenty of water for at least 15
minutes. Get medical attention.
Skin ContactIn case of contact, immediately flush skin with plenty of water. Remove contaminated clothing and shoes. Wash clothing
before reuse. Thoroughly clean shoes before reuse. Get medical attention.
InhalationIf the victim is not breathing, perform mouth-to-mouth resuscitation. Loosen tight clothing such as a collar, tie, belt or
waistband. If breathing is difficult, oxygen can be administered. Seek medical attention if respiration problems do not
improve.
IngestionINDUCE VOMITING by sticking finger in throat. Lower the head so that the vomit will not reenter the mouth and throat.
Loosen tight clothing such as a collar, tie, belt or waistband. If the victim is not breathing, perform mouth-to-mouth
resuscitation. Examine the lips and mouth to ascertain whether the tissues are damaged, a possible indication that the
toxic material was ingested; the absence of such signs, however, is not conclusive.

Section V.Fire and Explosion Data
Not available.
FlammabilityMay be combustible at high temperature.Auto-Ignition
Flash PointsFlammable LimitsNot available.
Not available.
Combustion ProductsThese products are toxic carbon oxides (CO, CO2).
Fire Hazards
Not available.
Explosion HazardsRisks of explosion of the product in presence of mechanical impact: Not available.
Risks of explosion of the product in presence of static discharge: Not available.
Fire Fighting Media
SMALL FIRE: Use DRY chemical powder.
LARGE FIRE: Use water spray, fog or foam. DO NOT use water jet.
and Instructions
Continued on Next Page
exo-3,6-Epoxy-1,2,3,6-tetrahydrophthalic Acid

Section VI.Accidental Release Measures
Spill CleanupUse a shovel to put the material into a convenient waste disposal container. Finish cleaning the spill by rinsing any
contaminated surfaces with copious amounts of water. Consult federal, state, and/or local authorities for assistance on
Instructions
disposal.

Section VII. Handling and Storage
Keep away from heat. Mechanical exhaust required. When not in use, tightly seal the container and store in a dry, cool
Handling and Storage
place. Avoid excessive heat and light. Do not breathe dust.
Information
Always store away from incompatible compounds such as oxidizing agents.

Section VIII. Exposure Controls/Personal Protection
Engineering ControlsUse process enclosures, local exhaust ventilation, or other engineering controls to keep airborne levels below
recommended exposure limits. If user operations generate dust, fume or mist, use ventilation to keep exposure to
airborne contaminants below the exposure limit.
Personal ProtectionSplash goggles. Lab coat. Dust respirator. Boots. Gloves. Suggested protective clothing might not be sufficient; consult
a specialist BEFORE handling this product. Be sure to use a MSHA/NIOSH approved respirator or equivalent.
Exposure LimitsNot available.

Section IX. Physical and Chemical Properties
Solid. (White, Crystalline Powder.)Solubility
Physical state @ 20°CNot available.
Not available.
Specific Gravity
Molecular Weight184.15Partition CoefficientNot available.
Boiling Point
Not available.Vapor PressureNot applicable.
Melting Point129°C (264.2°F)Vapor DensityNot available.
Refractive IndexNot available.VolatilityNot available.
Critical TemperatureNot available.OdorNot available.
ViscosityNot available.TasteNot available.

Section X.Stability and Reactivity Data
Stability
This material is stable if stored under proper conditions. (See Section VII for instructions)
Conditions of InstabilityAvoid excessive heat and light.
IncompatibilitiesReactive with oxidizing agents.

Section XI. Toxicological Information
RN8793000
RTECS Number
Eye Contact. Ingestion. Inhalation.
Routes of Exposure
Toxicity DataMouse LD50 (intraperitoneal) 55 mg/kg
Chronic Toxic EffectsCARCINOGENIC EFFECTS : Not available.
MUTAGENIC EFFECTS : Not available.
TERATOGENIC EFFECTS : Not available.
DEVELOPMENTAL TOXICITY: Not available.
Repeated or prolonged exposure to this compound is not known to aggravate existing medical conditions.
Acute Toxic EffectsNo specific information is available in our data base regarding the toxic effects of this material for humans. However,
exposure to any chemical should be kept to a minimum. Skin and eye contact may result in irritation. May be harmful if
inhaled or ingested. Always follow safe industrial hygiene practices and wear proper protective equipment when handling
this compound.
Follow safe industrial hygiene practices and always wear proper protective equipment when handling this compound.
Continued on Next Page
exo-3,6-Epoxy-1,2,3,6-tetrahydrophthalic Acid

Section XII.Ecological Information
EcotoxicityNot available.
Not available.
Environmental Fate

Section XIII. Disposal Considerations
Recycle to process, if possible. Consult your local regional authorities. You may be able to dissolve or mix material with a
Waste Disposal
combustible solvent and burn in a chemical incinerator equipped with an afterburner and scrubber system. Observe all
federal, state and local regulations when disposing of the substance.

Section XIV. Transport Information
DOT ClassificationNot a DOT controlled material (United States).
Not applicable.
PIN Number
Proper Shipping Name
Not applicable.
Packing Group (PG)Not applicable.
DOT Pictograms

Section XV. Other Regulatory Information and Pictograms
TSCA Chemical InventoryThis product is NOT on the EPA Toxic Substances Control Act (TSCA) inventory. The following notices are required by 40
CFR 720.36 (C) for those products not on the inventory list:
(EPA)
(i) These products are supplied solely for use in research and development by or under the supervision of a technically
qualified individual as defined in 40 CFR 720.0 et sec.
(ii) The health risks of these products have not been fully determined. Any information that is or becomes available will be
supplied on an MSDS sheet.
WHMIS ClassificationNot available.
(Canada)
EINECS Number (EEC)Not available.
EEC Risk StatementsNot available.


SECTION 16 - ADDITIONAL INFORMATION
N/A

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RN8793000
CHEMICAL NAME :
7-Oxabicyclo(2.2.1)hept-5-ene-2,3-dicarboxylic acid, exo,exo-
CAS REGISTRY NUMBER :
28871-62-7
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H8-O5
MOLECULAR WEIGHT :
184.16

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
55 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JAFCAU Journal of Agricultural and Food Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB 57136, West End Stn., Washington, DC 20037) V.1- 1953- Volume(issue)/page/year: 35,823,1987

 Safety Information

Risk Phrases 36/37/38
Safety Phrases 26-36/37/39
HS Code 2932999099

 Synthetic Route

~10%

exo-3,6-epoxy-1,2,3,6-tetrahydrophthalic acid Structure

exo-3,6-epoxy-1...

CAS#:28871-62-7

Literature: Umezawa, Naoki; Tanaka, Kumi; Urano, Yasuteru; Kikuchi, Kazuya; Higuchi, Tsunehiko; Nagano, Tetsuo Angewandte Chemie - International Edition, 1999 , vol. 38, # 19 p. 2899 - 2901

~%

exo-3,6-epoxy-1,2,3,6-tetrahydrophthalic acid Structure

exo-3,6-epoxy-1...

CAS#:28871-62-7

Literature: Berson; Swidler Journal of the American Chemical Society, 1953 , vol. 75, p. 1721,1726 Journal of the American Chemical Society, 1954 , vol. 76, p. 4060,4066 Full Text Show Details Diels; Alder Justus Liebigs Annalen der Chemie, 1931 , vol. 490, p. 257,263 Full Text Show Details Eggelte et al. Tetrahedron, 1973 , vol. 29, p. 2491

 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

7-Oxa-bicyclo<2.2.1>hept-5-en-2-exo,3-cis-dicarbonsaeure
7-Oxa-bicyclo-<2.2.1>-hept-5-en-2,3-exo,exo-dicarbonsaeure
exo-3,6-Epoxy-1,2,3,6-tetrahydrophthalic
7-Oxa-norborn-5-en-2exo,3exo-dicarbonsaeure
7-Oxabicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid
Epoepoxyxytetrahydrophthalicacid
7-oxa-norborn-5-ene-2exo,3exo-dicarboxylic acid
3,6-Oxa-1,2,3,6-tetrahydrophthalic Acid