(E)-but-2-enal
C4H6O
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Identification
- CAS Number
- 4170-30-3
- EC Number
- 224-030-0
- UN Number
- 1143
- Index Number
- 605-009-00-9
- PubChem CID
- 447466
Physical-chemical properties
- Molecular Formula
- C4H6O
- Molar Mass
- 70.09 g/mol
- IUPAC Name
- (E)-but-2-enal
Chemical Identifiers
- InChI
- InChI=1S/C4H6O/c1-2-3-4-5/h2-4H,1H3/b3-2+
- InChI Key
- MLUCVPSAIODCQM-NSCUHMNNSA-N
Overview
(E)-but-2-enal (CAS 4170-30-3) is an α,β-unsaturated aldehyde with conjugated double bond system and characteristic carbonyl reactivity. This four-carbon aldehyde compound, also known by its IUPAC name (E)-but-2-enal, represents an important intermediate in organic synthesis and industrial chemistry. With the molecular formula C4H6O and a molecular weight of 70.09 g/mol, this substance exhibits the typical reactivity patterns of both aldehydes and alkenes due to its conjugated structure. The (E)-configuration indicates the trans-arrangement around the double bond, which influences both its physical properties and chemical behavior. The compound requires careful handling due to its significant safety profile, classified under multiple hazard categories including flammable liquid (Category 2), acute toxicity, and mutagenicity concerns. The presence of GHS pictograms GHS02, GHS08, GHS06, GHS05, and GHS09 indicates risks associated with flammability, health hazards, toxicity, corrosion, and environmental impact. Its ADR classification as Class 6.1 confirms its status as a toxic substance requiring specialized transport protocols. (E)-but-2-enal finds primary applications in organic synthesis as a building block for pharmaceuticals, agrochemicals, and specialty chemicals. Its reactive aldehyde group and conjugated system make it valuable for Diels-Alder reactions, nucleophilic additions, and other synthetic transformations. The compound also serves in flavor and fragrance industries, though in strictly controlled applications. Unlike simpler reactive compounds such as 2-(chloromethyl)oxirane, (E)-but-2-enal offers unique selectivity in synthetic pathways due to its extended conjugation. OYSI provides (E)-but-2-enal to qualified industrial customers with comprehensive safety documentation and regulatory compliance support throughout Europe.
Safety & Classification
Flam. Liq. 2; Muta. 2; Acute Tox. 2 *; Acute Tox. 3 *; Acute Tox. 3 *; STOT SE 3; STOT RE 2 *; Sk...
GHS Pictograms
Flame
GHS02
Flammable. May ignite on contact with air, water, or heat sources.
Health Hazard
GHS08
Serious health hazard. May cause cancer, organ damage, or genetic defects.
Skull and Crossbones
GHS06
Acute toxicity. Fatal if swallowed, in contact with skin, or if inhaled.
Corrosion
GHS05
Corrosive. Causes severe skin burns and eye damage.
Environment
GHS09
Environmental hazard. Toxic to aquatic life with long lasting effects.
HHazard Statements (H-Statements)
Describe the nature and severity of the hazard
Highly flammable liquid and vapour.
Suspected of causing genetic defects.
Fatal if inhaled.
Toxic in contact with skin.
Toxic if swallowed.
May cause respiratory irritation.
May cause damage to organs through prolonged or repeated exposure.
Causes skin irritation.
Causes serious eye damage.
Very toxic to aquatic life.
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
Inhalation
Measures if vapours or dust are inhaled
Skin Contact
Measures if substance contacts the skin
Eye Contact
Measures if substance gets into the eyes
First Aid Actions
- +P305IF IN EYES:
- +P351Rinse cautiously with water for several minutes.
- +P338Remove contact lenses, if present and easy to do. Continue rinsing.
- +P313Get medical advice/attention.
Related hazard statements:
Ingestion
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 Number | 1143 |
| ADR Class | 6.1 |
| Packing Group | I |
| Tunnel Code | C/D |
| Proper Shipping Name | Crotonaldehyd, stabilisiert |
| Marine Pollutant | No |
Frequently Asked Questions
What is (E)-but-2-enal?
(E)-but-2-enal is an unsaturated aldehyde with the molecular formula C4H6O and CAS number 4170-30-3. This organic compound features a four-carbon chain with a double bond in the E-configuration between carbons 2 and 3, and an aldehyde functional group. With a molecular weight of 70.09 g/mol, it is classified as a hazardous chemical requiring careful handling due to its flammable, toxic, and mutagenic properties.
What are the physicochemical properties of (E)-but-2-enal?
(E)-but-2-enal is a liquid at room temperature with characteristic aldehyde properties. As an α,β-unsaturated aldehyde, it typically exhibits a pungent, irritating odor. The compound is flammable with moderate volatility due to its low molecular weight. Its unsaturated structure makes it reactive toward nucleophiles and prone to polymerization. The molecule's polarity allows for some water solubility while maintaining good solubility in organic solvents.
What is (E)-but-2-enal used for?
(E)-but-2-enal is primarily used as an intermediate in organic synthesis and chemical manufacturing. Its reactive aldehyde and alkene functional groups make it valuable for producing pharmaceuticals, agrochemicals, and specialty chemicals. It serves as a building block in the synthesis of more complex molecules and may be used in flavor and fragrance applications, though its toxicity limits direct consumer use. Industrial applications focus on controlled chemical transformations.
How to handle (E)-but-2-enal safely?
(E)-but-2-enal requires strict safety protocols due to its acute toxicity and mutagenic properties. Personnel must wear appropriate PPE including chemical-resistant gloves, safety goggles, and respiratory protection. Work should be conducted in well-ventilated areas or fume hoods to prevent inhalation exposure. Avoid skin contact and ingestion completely. Use explosion-proof equipment due to its flammable nature, and ensure emergency procedures are readily available for immediate response to exposure incidents.
How to store (E)-but-2-enal correctly?
(E)-but-2-enal must be stored in a cool, dry, well-ventilated area away from heat sources, ignition sources, and incompatible materials. Use appropriate secondary containment and ensure containers are tightly sealed to prevent vapor release. Store separately from oxidizing agents, bases, and reactive chemicals. Implement temperature control to prevent degradation and maintain product stability. Access should be restricted to trained personnel only, with proper inventory tracking and safety documentation.
What to do in case of contact with (E)-but-2-enal?
(E)-but-2-enal exposure requires immediate emergency response due to its acute toxicity. For skin contact, immediately remove contaminated clothing and flush with copious amounts of water for at least 15 minutes. If inhaled, move to fresh air immediately and seek medical attention. For eye contact, rinse thoroughly with water and remove contact lenses if present. Never induce vomiting if ingested. Seek immediate medical attention for all exposure routes and provide SDS to medical personnel.
How to dispose of (E)-but-2-enal appropriately?
(E)-but-2-enal disposal must comply with local, national, and EU waste regulations due to its hazardous classification. The substance cannot be disposed of as regular waste and requires specialized hazardous waste treatment. Contact licensed waste disposal companies experienced with toxic organic compounds. Incineration at appropriate temperatures may be suitable, but requires proper emission controls. Empty containers may also require special handling. Always consult current waste codes and disposal regulations before disposal.
How to transport (E)-but-2-enal?
(E)-but-2-enal is classified under ADR as Class 6.1 (toxic substances), Packing Group I, indicating high toxicity requiring stringent transport controls. Shipments must use UN-approved packaging designed for toxic liquids, with proper labeling including GHS pictograms for toxicity, flammability, and health hazards. Transport documentation must include emergency response information and contact details. Only qualified carriers experienced with hazardous materials should handle transportation, following all ADR requirements for routing and vehicle specifications.
Is (E)-but-2-enal subject to specific regulations?
(E)-but-2-enal is subject to comprehensive EU chemical regulations including REACH registration requirements and CLP classification obligations. Its mutagenic properties (Muta. 2) and acute toxicity place it under strict regulatory oversight. While not currently listed as an SVHC, its hazard profile requires compliance with occupational exposure limits and risk management measures. Users must maintain safety data sheets, implement appropriate risk assessments, and ensure worker protection measures meet regulatory standards throughout the supply chain.
Where to buy (E)-but-2-enal in Europe?
(E)-but-2-enal is available through specialized chemical distributors experienced with hazardous materials handling. OYSI, as a European chemical distributor, can provide access to this regulated substance along with proper documentation, safety data sheets, and regulatory compliance support. Due to its hazardous classification, purchases typically require verification of intended use, appropriate handling capabilities, and regulatory compliance. Professional buyers should ensure their suppliers maintain proper licensing and quality certifications for hazardous chemical distribution.
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Data Sources
Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.