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
1279713-77-7
Chemical name
CU CPT 4a
Molecular formula
C18H13ClFNO3S
Molecular weight
377.8 g/mol
Synonyms
CUCPT4a; CU-CPT 4a; TLR3-IN-1; (3-Chloro-6-fluorobenzo[b]thiophene-2-carbonyl)-D-phenylalanine; N-[(3-Chloro-6-fluorobenzo[b]thien-2-yl)carbonyl]-D-phenylalanine; (R)-2-(3-chloro-6-fluorobenzo[b]thiophene-2-carboxamido)-3-phenylpropanoic acid; CU-CPT-4a; C18H13ClFNO3S; (2R)-2-[(3-chloro-6-fluoro-1-benzothiophen-2-yl)formamido]-3-phenylpropanoic acid; IAASQMCXDRISAV-CYBMUJFWSA-N; G79325; T22698
InChIKey
IAASQMCXDRISAV-CYBMUJFWSA-N
PubChem CID
53242268
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.
- Protect from light and moisture.
- Wear appropriate personal protective equipment, including a lab coat.
- Use compatible chemical-resistant gloves.
- Wear approved eye protection, such as safety goggles or a face shield.
- If ventilation is inadequate, wear respiratory protection.
First Aid / Accidental Release
- In case of inhalation, move to fresh air. If not breathing, give artificial respiration. Seek medical attention according to institutional procedures.
- In case of skin contact, wash off with soap and plenty of 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 immediately.
- Evacuate personnel to safe areas. Keep unnecessary personnel away.
- Avoid dust or aerosol generation. Avoid breathing dust, vapors, mist, or gas.
- Ensure adequate ventilation. Use appropriate personal protective equipment.
- Collect spillage using trained-lab procedures. Place in suitable, closed containers for disposal.
- Prevent further leakage or spillage if safe to do so. Do not let product enter drains.
Firefighting / Stability
- Use water spray, alcohol-resistant foam, dry chemical, or carbon dioxide for extinguishing.
- Wear self-contained breathing apparatus for firefighting if necessary.
- Keep containers cool with water spray.
- Prevent fire-fighting water from entering drains or water courses.
- Stable under recommended storage conditions.
- May react with strong oxidizing agents.
- Avoid strong acids and strong bases.
- Hazardous decomposition products may include carbon oxides, nitrogen oxides, sulfur oxides, hydrogen chloride, and hydrogen fluoride.
Physical and Chemical Reference
Appearance
White solid
Catalog reference value; verify against supplier SDS before use.
Physical State
Solid
Catalog reference value; verify against supplier SDS before use.
Melting Point
185.0 °C
Catalog reference value; verify against supplier SDS before use.
Boiling Point
450.0 °C
Catalog reference value; verify against supplier SDS before use.
Density
1.54 g/cm³
Catalog reference value; verify against supplier SDS before use.
Water Solubility
Sparingly soluble
Catalog reference value; verify against supplier SDS before use.
Flash Point
335.3 °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
500.0 °C
Catalog reference value; verify against supplier SDS before use.
Transport / Shipment Review
HS6
293499
Preliminary catalog cue; verify before compliance decisions.
HS Code
293499
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.