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120929-15-9

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Basic Information
CAS No.: 120929-15-9
Name: N-(2,5-DIANILINOMETHYLENECYCLOPENTYLIDENE)DIPHENYLAMINIUM PERCHLORATE
Molecular Structure:
Molecular Structure of 120929-15-9 (N-(2,5-DIANILINOMETHYLENECYCLOPENTYLIDENE)DIPHENYLAMINIUM PERCHLORATE)
Formula: C31H27N3.HClO4
Molecular Weight: 542.02
Synonyms: N-(2,5-DIANILINOMETHYLENECYCLOPENTYLIDENE)DIPHENYLAMINIUM PERCHLORATE;N-{(2E,5E)-2,5-bis[(phenylamino)methylidene]cyclopentylidene}-N-phenylanilinium perchlorate;
PSA: 101.34000
LogP: 8.10840
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Specification

The N-Phenyl-N-[5-[(phenylamino)methylene]-2-[(phenylimino)methyl]-1-cyclopenten-1-yl]benzenamine perchlorate, with the cas registry number 120929-15-9, has the systematic name of N-{(2E,5E)-2,5-bis[(phenylamino)methylidene]cyclopentylidene}-N-phenylanilinium perchlorate. And the molecular formula of the chemical is C31H27N3.HClO4.

The characteristics of this chemical are as followings: (1)#H bond acceptors: 3; (2)#H bond donors: 2; (3)#Freely Rotating Bonds: 6; (4)Polar Surface Area: 9.49 Å2.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [O-]Cl(=O)(=O)=O.c5cc(/[N+](c1ccccc1)=C4\C(=C\Nc2ccccc2)CCC4=C/Nc3ccccc3)ccc5
(2)InChI: InChI=1/C31H27N3.ClHO4/c1-5-13-27(14-6-1)32-23-25-21-22-26(24-33-28-15-7-2-8-16-28)31(25)34(29-17-9-3-10-18-29)30-19-11-4-12-20-30;2-1(3,4)5/h1-20,23-24H,21-22H2,(H,32,33);(H,2,3,4,5)
(3)InChIKey: VOQSATMHDWZPKW-UHFFFAOYAX