1,3,5-Tri(4-carboxyphenyl)benzene

• Catalog Number: ACM50446441
• Product Name: 1,3,5-Tri(4-carboxyphenyl)benzene
• CAS: 50446-44-1
• Category: Renewable & Alternative Energy
• Synonyms: 4-[3,5-bis(4-carboxyphenyl)phenyl]benzoic acid
• IUPAC Name: 4-[3,5-bis(4-carboxyphenyl)phenyl]benzoic acid
• Molecular Weight: 438.42
• Molecular Formula: C27H18O6
• InChI: InChI=1S/C27H18O6/c28-25(29)19-7-1-16(2-8-19)22-13-23(17-3-9-20(10-4-17)26(30)31)15-24(14-22)18-5-11-21(12-6-18)27(32)33/h1-15H,(H,28,29)(H,30,31)(H,32,33)
• InChI Key: SATWKVZGMWCXOJ-UHFFFAOYSA-N
• Complexity: 588
• CompoundIs Canonicalized: Yes
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Exact Mass: 438.11033829g/mol
• Formal Charge: 0
• Heavy Atom Count: 33
• Hydrogen Bond Acceptor Count: 6
• Hydrogen Bond Donor Count: 3
• Isotope Atom Count: 0
• Monoisotopic Mass: 438.11033829g/mol
• Physical State: Off-white solid
• Rotatable Bond Count: 6
• Topological Polar Surface Area: 112Ų
• Undefined Atom Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• XLogP3: 5.4