Dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate

C20H26O6

dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate

CAS83-59-0
GHS06 Gefahrensymbol: Giftig – Totenkopf mit Knochen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

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Identification

CAS Number
83-59-0
UN Number
2811
Index Number
607-168-00-X
PubChem CID
6750

Physical-chemical properties

Molecular Formula
C20H26O6
Molar Mass
362.40 g/mol
IUPAC Name
dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate

Chemical Identifiers

InChI
InChI=1S/C20H26O6/c1-4-6-23-19(21)17-12(3)8-13-9-15-16(26-11-25-15)10-14(13)18(17)20(22)24-7-5-2/h9-10,12,17-18H,4-8,11H2,1-3H3
InChI Key
UEKQGZQLUMSLNW-UHFFFAOYSA-N

Overview

Dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate (CAS 83-59-0) is an organic ester compound with benzodioxole structure and significant toxicological properties. This complex organic molecule features a tetrahydrobenzo[f][1,3]benzodioxole core structure with two propyl ester groups and a methyl substituent. With a molecular formula of C20H26O6 and molecular weight of 362.4 g/mol, this compound belongs to the family of aromatic esters commonly used in specialized industrial applications. The benzodioxole ring system provides unique chemical properties that distinguish it from simpler aromatic compounds, making it valuable for specific technical processes where conventional alternatives like N-methylaniline may not provide the required performance characteristics. The compound presents significant safety considerations, classified under multiple acute toxicity categories (Acute Tox. 3 and 4) and carrying severe aquatic toxicity classifications (Aquatic Acute 1, Aquatic Chronic 1). The GHS06 and GHS09 pictograms indicate both acute toxicity and environmental hazards, requiring careful handling protocols and specialized storage conditions. Transportation falls under ADR class 6.1, designating it as a toxic substance requiring appropriate documentation and safety measures during shipment. Primary industrial applications include use as an intermediate in pharmaceutical synthesis, specialty chemical manufacturing, and advanced materials production. The compound's unique structural features make it particularly valuable in processes requiring specific stereochemical properties and controlled reactivity profiles. Additionally, it serves as a building block for more complex molecular architectures in fine chemical synthesis. OYSI maintains reliable supply chains for this specialized compound, ensuring consistent availability for European industrial customers requiring high-quality chemical intermediates.

Safety & Classification

Danger
Classification:

Acute Tox. 3 *; Acute Tox. 4 *; Aquatic Acute 1; Aquatic Chronic 1

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H311

Toxic in contact with skin.

H302

Harmful if swallowed.

H400

Very toxic to aquatic life.

H410

Very toxic to aquatic life with long lasting effects.

Classification according to CLP Regulation (EC) No 1272/2008. The complete list of hazard and precautionary statements can be found in the Safety Data Sheet (SDS).

First Aid Measures

Skin Contact

Toxic

Measures if substance contacts the skin

First Aid Actions

  • +P302IF ON SKIN:
  • +P352Wash with plenty of water.
  • +P361Take off immediately all contaminated clothing.
  • +P313Get medical advice/attention.

Related hazard statements:

Ingestion

Harmful

Measures if substance is accidentally swallowed

First Aid Actions

  • +P301IF SWALLOWED:
  • +P330Rinse mouth.
  • +P331Do NOT induce vomiting.
  • +P310Immediately call a POISON CENTER/doctor.

Related hazard statements:

General Measures

Emergency 112 | Poison Control: +49 30 19240 (DE), +33 1 45 42 59 59 (FR), +31 30 274 88 88 (NL)

First aid measures are based on CLP classification and associated P-statements. They do not replace the Safety Data Sheet (SDS). In case of emergency, always consult the full SDS and a physician.

Transport (ADR)

UN Number2811
ADR Class6.1
Packing GroupIII
Tunnel CodeE
Proper Shipping NameDipropyl-6,7-methylendioxy-1,2,3,4-tetrahydro-3-methylnaphthalin-1,2-dicarboxylat
Marine PollutantNo

Frequently Asked Questions

What is dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate?

Dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate is an organic chemical compound with CAS number 83-59-0 and molecular formula C20H26O6. This substance has a molecular weight of 362.4 g/mol and belongs to the benzodioxole family of compounds. It is classified as a hazardous substance with acute toxicity properties and environmental toxicity, requiring careful handling and appropriate safety measures during use and storage.

What are the physicochemical properties of dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate?

Dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate has a molecular weight of 362.4 g/mol and molecular formula C20H26O6. As an organic ester compound containing benzodioxole rings, it typically exhibits moderate to low water solubility due to its hydrophobic aromatic structure and ester groups. The compound's physical state, color, and odor characteristics would depend on purity and specific manufacturing conditions, requiring consultation of detailed technical data sheets for precise specifications.

What is dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate used for?

Dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate is primarily used in specialized chemical synthesis and research applications. Its benzodioxole structure makes it valuable as an intermediate in pharmaceutical research, organic synthesis, and potentially in the development of bioactive compounds. The compound may also serve as a building block for more complex molecular structures in medicinal chemistry and advanced material science applications requiring specific aromatic ester functionalities.

How to handle dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate safely?

Safe handling requires appropriate personal protective equipment including chemical-resistant gloves, safety goggles, and protective clothing due to its Acute Tox. 3 and 4 classifications. Work in well-ventilated areas or under fume hoods to prevent inhalation exposure. Avoid skin and eye contact, and prevent release to the environment given its aquatic toxicity classification. Always follow DANGER signal word precautions, maintain good hygiene practices, and ensure emergency procedures are readily available before handling this substance.

How to store dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate correctly?

Proper storage requires keeping the substance in tightly sealed containers in a cool, dry, well-ventilated area away from incompatible materials. Given its acute toxicity classification, store in designated hazardous chemical areas with restricted access and appropriate warning labels. Prevent environmental release due to its aquatic toxicity properties. Maintain temperatures within manufacturer specifications and ensure containers are properly labeled with GHS06 and GHS09 pictograms. Regular inventory checks and leak inspections are essential for safe storage management.

What to do in case of contact with dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate?

Immediate first aid measures include removing contaminated clothing and rinsing affected skin or eyes with plenty of clean water for at least 15 minutes. If inhaled, move the person to fresh air immediately and seek medical attention if breathing difficulties occur. In case of ingestion, do not induce vomiting and seek immediate medical attention. Given the Acute Tox. 3 and 4 classifications, contact emergency services promptly for any significant exposure and provide them with the safety data sheet information.

How to dispose of dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate appropriately?

Disposal must comply with local, national, and EU waste regulations for hazardous chemicals classified under ADR Class 6.1. The substance requires treatment as hazardous waste due to its acute toxicity and environmental hazard classifications. Contact licensed hazardous waste disposal companies for proper collection and treatment. Prevent environmental release given its Aquatic Acute 1 and Aquatic Chronic 1 classifications. Empty containers should also be treated as hazardous waste and disposed of through appropriate channels.

How to transport dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate?

Transportation falls under ADR Class 6.1 (toxic substances) Packing Group III regulations. Packages must display appropriate hazard labels and markings including UN identification numbers and proper shipping names. Vehicles must carry appropriate emergency equipment and documentation including transport emergency cards. Drivers require ADR certification for Class 6.1 substances. Ensure packaging meets UN specification requirements for Packing Group III and prevent environmental release during transport due to the substance's aquatic toxicity classification.

Is dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate subject to specific regulations?

The substance is subject to CLP regulation classification as Acute Tox. 3, Acute Tox. 4, Aquatic Acute 1, and Aquatic Chronic 1 with DANGER signal word. It requires GHS06 and GHS09 pictograms on labels and safety data sheets. While not currently listed as SVHC under REACH, it must comply with standard registration, evaluation, and authorization requirements. ADR Class 6.1 Group III transportation regulations also apply. Users must follow occupational exposure limits and environmental protection measures as specified by relevant national authorities.

Where to buy dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate in Europe?

OYSI serves as a reliable European distributor for dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate, providing quality chemical products to industrial and research customers across Europe. As a specialized chemical distributor, OYSI ensures proper handling, documentation, and regulatory compliance for hazardous substances like this ADR Class 6.1 material. Contact OYSI directly for availability, technical specifications, safety data sheets, and regulatory documentation required for your specific application and location within Europe.

Services for Dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate

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Dipropyl 7-methyl-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-5,6-dicarboxylate is a dangerous good. We support you with labeling, packaging, and transport documentation.

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Data Sources

Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.