1,3,6,8-Tetraphenylpyrene

• CAS: 13638-82-9
• Catalog Number: ACM13638829-1
• Category: Other Products
• Molecular Weight: 506.63
• Molecular Formula: C40H26
• Synonyms: 1,3,6,8-TETRAPHENYLPYRENE
• IUPAC Name: 1,3,6,8-tetraphenylpyrene
• Canonical SMILES: C1=CC=C(C=C1)C2=CC(=C3C=CC4=C(C=C(C5=C4C3=C2C=C5)C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8
• InChI: InChI=1S/C40H26/c1-5-13-27(14-6-1)35-25-36(28-15-7-2-8-16-28)32-23-24-34-38(30-19-11-4-12-20-30)26-37(29-17-9-3-10-18-29)33-22-21-31(35)39(32)40(33)34/h1-26H
• InChI Key: SIJHJHYRYHIWFW-UHFFFAOYSA-N
• Boiling Point: 659.2 °C at 760 mmHg
• Melting Point: 299 °C
• Appearance: Light orange to yellow to green powder to crystal
• Storage: Store under inert gas
• Complexity: 672
• Condition To Avoid: Light Sensitive,Air Sensitive
• Covalently-Bonded Unit Count: 1
• Exact Mass: 506.203451g/mol
• Formal Charge: 0
• Hazard Statements: H372 : Causes damage to organs through prolonged or repeated exposure.H317 : May cause an allergic skin reaction.H334 : May cause allergy or asthma symptoms or breathing difficulties if inhaled.H350 : May cause cancer.
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• Heavy Atom Count: 40
• MDL Number: MFCD00021662
• Monoisotopic Mass: 506.203451g/mol
• NSC Number: 84256
• Precautionary Statements: P501 : Dispose of contents/ container to an approved waste disposal plant.P260 : Do not breathe dust/ fume/ gas/ mist/ vapors/ spray.P270 : Do not eat, drink or smoke when using this product.P202 : Do not handle until all safety precautions have been read and understood.P285 : In case of inadequate ventilation wear respiratory protection.P201 : Obtain special instructions before use.P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ protective clothing/ eye protection/ face protection.P272 : Contaminated work clothing must not be allowed out of the workplace.P308 + P313 : IF exposed or concerned: Get medical advice/ attention.P304 + P341 : IF INHALED: If breathing is difficult, remove person to fresh air and keep comfortable for breathing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P333 + P313 : If skin irritation or rash occurs: Get medical advice/ attention.P363 : Wash contaminated clothing before reuse.P405 : Store locked up.
• Rotatable Bond Count: 4
• Signal Word: Danger
• XLogP3: 11.5