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10,10'-Bis([1,1'-biphenyl]-4-yl)-9,9'-bianthracene

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Name

10,10'-Bis([1,1'-biphenyl]-4-yl)-9,9'-bianthracene

EINECS
CAS No. 172285-79-9 Density 1.192 g/cm3
Solubility Melting Point
Formula C52H34 Boiling Point
Molecular Weight 658.83 Flash Point
Transport Information Appearance
Safety Risk Codes
Molecular Structure Molecular Structure of 172285-79-9 (9,9'-Bianthracene,10,10'-bis([1,1'-biphenyl]-4-yl)-) Hazard Symbols
Synonyms

10,10'-Bis([1,1'-biphenyl]-4-yl)-9,9'-bianthracene;

 

10,10'-Bis([1,1'-biphenyl]-4-yl)-9,9'-bianthracene Specification

The 10,10'-Bis([1,1'-biphenyl]-4-yl)-9,9'-bianthracene with the CAS number 172285-79-9 is also called 9,9'-Bianthracene,10,10'-bis([1,1'-biphenyl]-4-yl)-. Its molecular formula is C52H34. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 10,10'-Bis([1,1'-biphenyl]-4-yl)-9,9'-bianthracene are: (1)ACD/LogP: 15.73; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): 15.73; (4)ACD/LogD (pH 7.4): 15.73; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 5; (12)Index of Refraction: 1.73; (13)Molar Refractivity: 220.58 cm3; (14)Molar Volume: 552.3 cm3; (15)Polarizability: 87.44×10-24cm3; (16)Surface Tension: 52.8 dyne/cm.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(ccc1)c2ccc(cc2)c%10c3ccccc3c(c8c4ccccc4c(c5ccc(cc5)c6ccccc6)c7ccccc78)c9ccccc9%10
(2)InChI: InChI=1/C52H34/c1-3-15-35(16-4-1)37-27-31-39(32-28-37)49-41-19-7-11-23-45(41)51(46-24-12-8-20-42(46)49)52-47-25-13-9-21-43(47)50(44-22-10-14-26-48(44)52)40-33-29-38(30-34-40)36-17-5-2-6-18-36/h1-34H
(3)InChIKey: KIQHGZHPNCGQJY-UHFFFAOYAH

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