1,3-Bis[(phenylseleno)methyl]benzene

• CAS: 239448-30-7
• Catalog Number: ACM239448307
• Category: Other Products
• Molecular Weight: 416.28
• Molecular Formula: C₂₀H₁₈Se₂
• Synonyms: 239448-30-7, AGN-PC-00E3YM, CTK4F2617, KNRBPZAUCBNUPW-UHFFFAOYSA-, 1,3-Bis(phenylselenomethyl)benzene, 1,3-Bis[(phenylseleno)methyl]benzene, AG-E-70513, Benzene,1,3-bis[(phenylseleno)methyl]-, Benzene, 1,3-bis[(phenylseleno)methyl]-, InChI=1/C20H18Se2/c1-3-10-19(11-4-1)21-15-17-8-7-9-18(14-17)16-22-20-12-5-2-6-13-20/h1-14H,15-16H2
• IUPAC Name: 1,3-bis(phenylselanylmethyl)benzene
• Canonical SMILES: C1=CC=C(C=C1)[Se]CC2=CC(=CC=C2)C[Se]C3=CC=CC=C3
• InChI: InChI=1S/C20H18Se2/c1-3-10-19(11-4-1)21-15-17-8-7-9-18(14-17)16-22-20-12-5-2-6-13-20/h1-14H,15-16H2
• InChI Key: KNRBPZAUCBNUPW-UHFFFAOYSA-N
• Melting Point: 38-42ºC
• Flash Point: 110ºC
• Complexity: 264
• Covalently-Bonded Unit Count: 1
• Exact Mass: 417.97400
• Hazard Statements: T: Toxic
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• Heavy Atom Count: 22
• Monoisotopic Mass: 417.974g/mol
• Rotatable Bond Count: 6
• Safety Description: 36/37-45
• Topological Polar Surface Area: 0A^2