9,10-Di(1-naphthyl)anthracene CAS NO.26979-27-1

1. Introduction of9,10-Di(1-naphthyl)anthracene The 9,10-Di(1-naphthyl)anthracene, with its CAS NO26979-27-1, is a kind of whit…

 1. Introduction of 9,10-Di(1-naphthyl)anthracene

 

The 9,10-Di(1-naphthyl)anthracene, with its CAS NO 26979-27-1, is a kind of white or light yellow powder. It has synonyms of Anthracene,9,10-di-1-naphthyl- (6CI,7CI,8CI);9,10-Di(a-naphthylanthracene) and NSC 90485. 9,10-Di(1-naphthyl)anthracene should be stored in shady and cool warehouse.
 

2. Properties of 9,10-Di(1-naphthyl)anthracene

 

(1) XLogP3-AA 10.2 (2) Rotatable Bond Count 2 (3) Exact Mass 430.172151 
(4) MonoIsotopic Mass 430.172151 (5) Heavy Atom Count 34 (6) Complexity 598 
(7) Covalently-Bonded Unit Count 1 (8) Feature 3D Ring Count 7 (9) Effective Rotor Count 2 
(10) Conformer Sampling RMSD 0.8 (11) CID Conformer Count 2

 

3. Strucuture descriptors of 9,10-Di(1-naphthyl)anthracene

 

IUPAC Name: 9,10-dinaphthalen-1-ylanthracene

InChI: InChI=1S/C34H22/c1-3-15-25-23(11-1)13-9-21-27(25)33-29-17-5-7-19-31(29)
34(32-20-8-6-18-30(32)33)28-22-10-14-24-12-2-4-16-26(24)28/h1-22H

InChIKey: GWNJZSGBZMLRBW-UHFFFAOYSA-N

Canonical SMILES : C1=CC=C2C(=C1)C=CC=C2C3=C4C=CC=CC4=C(C5=CC=CC=C53)C6=CC=CC7=CC=CC=C76