5''-(4'-Amino-[1,1'-Biphenyl]-4-Yl)-[1,1':4',1'':3'',1''':4''',1''''-Quinquephenyl]-4,4''''-Diamine - ≥98% , CAS No.1400987-00-9

CAS: 1400987-00-9 Cat. No.: A302816 Molecular Weight: 579.732 EC Number: 986-996-6

GRADE & PURITY ≥98%

Synonyms

1,3,5-Tris[4’-Amino(1,1-Biphenyl-4-Yl)]Benzene

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyms

1, 3, 5-Tris[4’-Amino(1, 1-Biphenyl-4-Yl)]Benzene

Specifications & Purity

≥98%

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488202739
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488202739
• Canonical Smiles: C1=CC(=CC=C1C2=CC=C(C=C2)N)C3=CC(=CC(=C3)C4=CC=C(C=C4)C5=CC=C(C=C5)N)C6=CC=C(C=C6)C7=CC=C(C=C7)N
• IUPAC Name: 4-[4-[3,5-bis[4-(4-aminophenyl)phenyl]phenyl]phenyl]aniline
• InChIKey: QEDIHRCMTOLXBO-UHFFFAOYSA-N
• INCHI: 1S/C42H33N3/c43-40-19-13-31(14-20-40)28-1-7-34(8-2-28)37-25-38(35-9-3-29(4-10-35)32-15-21-41(44)22-16-32)27-39(26-37)36-11-5-30(6-12-36)33-17-23-42(45)24-18-33/h1-27H,43-45H2
• Molecular Weight: 579.732
• Reaxy-Rn: 30959622
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=30959622&ln=

Chemical and Physical Properties

• Molecular Weight: 579.700 g/mol
• XLogP3: 9.600
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 579.267 Da
• Monoisotopic Mass: 579.267 Da
• Topological Polar Surface Area: 78.100 Ų
• Heavy Atom Count: 45
• Formal Charge: 0
• Complexity: 730.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1