Preliminary reference disclaimer
This preliminary safety reference is generated from structured MolGraph catalog fields and public reference-style data. It is not a supplier-issued Safety Data Sheet and should not be used as a substitute for supplier-issued documentation, workplace safety review, transport classification, or regulatory compliance decisions. For supplier SDS or COA, submit a documentation request through MolGraph.
Identity
CAS Number
1804406-50-5
Chemical name
Methyl 5-bromo-2-cyano-3-(trifluoromethyl)benzoate
Molecular formula
C10H5BrF3NO2
Molecular weight
308.05 g/mol
Synonyms
857-767-7; methyl5-bromo-2-cyano-3-(trifluoromethyl)benzoate
InChIKey
CIBUNEJZNOODFE-UHFFFAOYSA-N
PubChem CID
134645872
Hazard / GHS Reference
GHS Pictograms
GHS07
Catalog reference cue; confirm supplier documentation before use.
Handling & PPE
- Handle in a well-ventilated area or fume hood.
- Avoid inhalation, ingestion, and skin/eye contact.
- Keep container tightly closed in a dry and well-ventilated place.
- Store away from incompatible materials.
- Use appropriate PPE such as lab coat, compatible gloves, and eye protection.
- Wear chemical-resistant gloves, such as nitrile or neoprene, suitable for the task.
- Wear safety glasses or chemical safety goggles.
- Use respiratory protection if ventilation is inadequate or if there is a risk of dust/aerosol exposure.
- Dispose through approved chemical waste channels according to local and institutional regulations.
First Aid / Accidental Release
- In case of inhalation, move to fresh air. If not breathing, give artificial respiration. Seek medical attention.
- For skin contact, wash immediately with plenty of soap and water. Remove contaminated clothing and shoes. Seek medical attention if irritation persists.
- In case of eye contact, rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing. Seek medical attention.
- If swallowed, rinse mouth with water. Do NOT induce vomiting. Seek medical attention.
- Evacuate personnel to safe areas. Keep unnecessary and unprotected personnel from entering.
- Avoid dust or aerosol generation. Avoid breathing dust, vapors, mist, or gas.
- Contain spill and collect with an inert absorbent material. Place in suitable, closed containers for disposal.
- Ensure adequate ventilation during cleanup.
- Dispose through approved chemical waste channels according to local and institutional regulations.
Firefighting / Stability
- Use dry chemical, carbon dioxide, water spray, or alcohol-resistant foam for extinguishing.
- Wear self-contained breathing apparatus and full protective gear for firefighting.
- Keep containers cool with water spray.
- Avoid inhalation of combustion products.
- This material is generally considered stable under recommended storage conditions.
- Avoid strong oxidizing agents, strong acids, and strong bases.
- May decompose under certain conditions, releasing hazardous fumes.
- No known hazardous reactions under normal conditions of use.
Physical and Chemical Reference
Appearance
White to off-white crystalline solid
Catalog reference value; verify against supplier SDS before use.
Physical State
Solid
Catalog reference value; verify against supplier SDS before use.
Melting Point
75.4 °C
Catalog reference value; verify against supplier SDS before use.
Boiling Point
253.3 °C
Catalog reference value; verify against supplier SDS before use.
Density
1.63 g/cm³
Catalog reference value; verify against supplier SDS before use.
Water Solubility
4.2 × 10⁻⁵ mol/L
Catalog reference value; verify against supplier SDS before use.
Flash Point
118.2 °C
Catalog reference value; verify against supplier SDS before use.
Vapor Pressure
Estimated very low; unit not specified
Catalog reference value; verify against supplier SDS before use.
Autoignition Temp
450.0 °C
Catalog reference value; verify against supplier SDS before use.
Transport / Shipment Review
HS6
292690
Preliminary catalog cue; verify before compliance decisions.
HS Code
292690
Source: catalog inference.
GHS Pictograms
GHS07
Preliminary catalog cue; verify before compliance decisions.
Compliance
standard-ruo
Preliminary catalog cue; verify before compliance decisions.
Registration Status
DSL: pending; AICS: pending; ENCS: pending; ICSR: pending; TSCA: pending; IECSC: pending; INSQR: pending; REACH: pending; K-REACH: pending; SEA_Regulatory: pending
Registration values are catalog reference status cues and may require jurisdiction-specific review.
Shipment review
Shipment details require review before fulfillment.
Preliminary catalog cue; verify before compliance decisions.
- Transport classification must be confirmed using supplier SDS and shipment documentation before dispatch.