Methyl 3-dimethoxyphosphoryloxybut-2-enoate

C7H13O6P

methyl 3-dimethoxyphosphoryloxybut-2-enoate

CAS7786-34-7
GHS06 Gefahrensymbol: Giftig – Totenkopf mit Knochen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
Danger

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Identification

CAS Number
7786-34-7
EC Number
232-095-1
UN Number
3018
Index Number
015-020-00-5
PubChem CID
9560

Physical-chemical properties

Molecular Formula
C7H13O6P
Molar Mass
224.15 g/mol
IUPAC Name
methyl 3-dimethoxyphosphoryloxybut-2-enoate

Chemical Identifiers

InChI
InChI=1S/C7H13O6P/c1-6(5-7(8)10-2)13-14(9,11-3)12-4/h5H,1-4H3
InChI Key
GEPDYQSQVLXLEU-UHFFFAOYSA-N

Overview

Methyl 3-dimethoxyphosphoryloxybut-2-enoate (CAS 7786-34-7) is an organophosphorus compound with acute toxicity properties and environmental hazard characteristics. This specialized organophosphate ester represents a significant chemical intermediate in various industrial processes, characterized by its unique molecular structure containing both ester and phosphate functional groups. With the molecular formula C7H13O6P and a molecular weight of 224.15 g/mol, this compound exhibits properties typical of organophosphorus derivatives while maintaining specific reactivity patterns that make it valuable in targeted applications. The substance is classified under multiple hazard categories, including Acute Toxicity Category 1 and 2, indicating severe health risks upon exposure. The presence of GHS06 (skull and crossbones) and GHS09 (environment) pictograms, along with the signal word "Danger," emphasizes the critical importance of proper handling protocols and safety measures during storage, transport, and use. Its ADR classification as Class 6.1 further reinforces the toxic nature of this compound, requiring specialized shipping and handling procedures. From a structural perspective, this compound shares certain characteristics with related organophosphorus derivatives such as diethoxy-(4-methylsulfinylphenoxy)-sulfanylidene-lambda5-phosphane, though each exhibits distinct reactivity profiles. The dimethoxyphosphoryl group provides specific chemical properties that distinguish it from other phosphate esters in industrial applications. Common industrial applications include use as a chemical intermediate in pharmaceutical synthesis, agricultural chemical production, and specialized organic synthesis processes. The compound's unique structure makes it particularly valuable in reactions requiring selective phosphorylation or as a building block in complex molecular assemblies. OYSI maintains availability of methyl 3-dimethoxyphosphoryloxybut-2-enoate for qualified industrial customers across Europe, ensuring compliance with all regulatory requirements and safety standards.

Safety & Classification

Danger
Classification:

Acute Tox. 1; Acute Tox. 2 *; Aquatic Acute 1; Aquatic Chronic 1

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H310

Fatal in contact with skin.

H300

Fatal 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

Fatal

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

Fatal

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 Number3018
ADR Class6.1
Packing GroupI
Tunnel CodeC/E
Proper Shipping NameMevinphos (ISO)
Marine PollutantNo

Frequently Asked Questions

What is methyl 3-dimethoxyphosphoryloxybut-2-enoate?

Methyl 3-dimethoxyphosphoryloxybut-2-enoate is an organophosphorus compound with the molecular formula C7H13O6P and CAS number 7786-34-7. This chemical substance has a molecular weight of 224.15 g/mol and belongs to the class of phosphate esters. It is classified as highly hazardous with acute toxicity properties and environmental dangers, requiring careful handling and specialized safety measures in industrial applications.

What are the physicochemical properties of methyl 3-dimethoxyphosphoryloxybut-2-enoate?

Methyl 3-dimethoxyphosphoryloxybut-2-enoate is an organic phosphorus compound with a molecular mass of 224.15 g/mol and the formula C7H13O6P. As an organophosphate ester, it typically exists as a liquid at room temperature with moderate volatility. The compound contains both ester and phosphate functional groups, which influence its solubility characteristics and chemical reactivity in various solvents and environmental conditions.

What is methyl 3-dimethoxyphosphoryloxybut-2-enoate used for?

Methyl 3-dimethoxyphosphoryloxybut-2-enoate is primarily used as an intermediate in organic synthesis and pharmaceutical manufacturing processes. This organophosphate compound serves as a building block for more complex molecules in chemical research and industrial applications. Due to its high toxicity classification (Acute Tox. 1 and 2), its use is restricted to specialized industrial settings with appropriate safety controls and trained personnel.

How to handle methyl 3-dimethoxyphosphoryloxybut-2-enoate safely?

Methyl 3-dimethoxyphosphoryloxybut-2-enoate requires maximum safety precautions due to its Acute Tox. 1 classification and 'Danger' signal word. Essential PPE includes full face protection, chemical-resistant gloves, protective clothing, and respiratory protection. Work must be conducted in well-ventilated areas or under fume hoods. Avoid skin and eye contact, inhalation, and ingestion. Emergency procedures and antidotes should be immediately available during handling operations.

How to store methyl 3-dimethoxyphosphoryloxybut-2-enoate correctly?

Methyl 3-dimethoxyphosphoryloxybut-2-enoate must be stored in a secure, temperature-controlled environment away from incompatible materials. Storage areas should be well-ventilated, locked, and accessible only to authorized personnel due to its high toxicity. Keep containers tightly sealed and protected from moisture, heat sources, and direct sunlight. Segregate from oxidizing agents, bases, and other reactive chemicals to prevent dangerous reactions.

What to do in case of contact with methyl 3-dimethoxyphosphoryloxybut-2-enoate?

Immediate medical attention is critical for any exposure to methyl 3-dimethoxyphosphoryloxybut-2-enoate due to its extreme toxicity. For skin contact, remove contaminated clothing and flush with copious amounts of water for at least 15 minutes. If inhaled, move to fresh air immediately. For eye contact, rinse thoroughly with water. Never induce vomiting if ingested. Contact poison control and emergency medical services immediately, providing the safety data sheet.

How to dispose of methyl 3-dimethoxyphosphoryloxybut-2-enoate appropriately?

Methyl 3-dimethoxyphosphoryloxybut-2-enoate must be disposed of as hazardous waste through licensed waste management companies due to its high toxicity and environmental hazard classifications. Never dispose of in regular waste streams, sewers, or soil. The substance requires specialized treatment methods such as high-temperature incineration or chemical neutralization. Follow all local, national, and EU waste regulations, maintaining proper documentation throughout the disposal process.

How to transport methyl 3-dimethoxyphosphoryloxybut-2-enoate?

Methyl 3-dimethoxyphosphoryloxybut-2-enoate is classified under ADR Class 6.1 (Toxic substances), Packing Group I, indicating maximum danger level for transport. Specialized packaging, labeling with GHS06 and GHS09 pictograms, and proper shipping documentation are mandatory. Only trained personnel and certified carriers can handle transportation. Vehicles must carry appropriate emergency equipment and spill containment materials. International transport requires compliance with IMDG and IATA dangerous goods regulations.

Is methyl 3-dimethoxyphosphoryloxybut-2-enoate subject to specific regulations?

Methyl 3-dimethoxyphosphoryloxybut-2-enoate is subject to strict European chemical regulations including REACH registration requirements and CLP classification. Its high toxicity profile (Acute Tox. 1/2) and environmental hazard status (Aquatic Acute/Chronic 1) trigger additional regulatory controls. While not currently listed as SVHC, it requires comprehensive safety assessments, exposure scenarios, and risk management measures. Import, distribution, and use may require specific authorizations and professional user restrictions.

Where to buy methyl 3-dimethoxyphosphoryloxybut-2-enoate in Europe?

Methyl 3-dimethoxyphosphoryloxybut-2-enoate is available through OYSI, a specialized European distributor of technical chemicals. As a highly toxic substance requiring professional handling, purchase is typically restricted to qualified industrial users, research institutions, and companies with appropriate safety infrastructure. OYSI provides comprehensive technical support, safety documentation, and regulatory compliance assistance to ensure proper handling and legal compliance throughout the European market.

Data Sources

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