CAS 75839-05-3 | 2,4,6-Tris(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-1-ium perchlorate | CAS Number 75839-05-3

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75839-05-3 | 2,4,6-Tris(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-1-ium perchlorate

CAS No: 75839-05-3 Catalog No: AG01EXAT MDL No:

Product Description

Catalog Number:

AG01EXAT

Chemical Name:

2,4,6-Tris(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-1-ium perchlorate

CAS Number:

75839-05-3

Molecular Formula:

C34H32ClNO4

Molecular Weight:

554.0752

IUPAC Name:

2,4,6-tris(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-1-ium;perchlorate

InChI:

InChI=1S/C34H32N.ClHO4/c1-24-5-13-28(14-6-24)23-35-33(30-17-9-26(3)10-18-30)21-32(29-15-7-25(2)8-16-29)22-34(35)31-19-11-27(4)12-20-31;2-1(3,4)5/h5-22H,23H2,1-4H3;(H,2,3,4,5)/q+1;/p-1

InChI Key:

YXQAVYUNCRWPBM-UHFFFAOYSA-M

SMILES:

[O-][Cl](=O)(=O)=O.Cc1ccc(cc1)c1cc(cc([n+]1Cc1ccc(cc1)C)c1ccc(cc1)C)c1ccc(cc1)C

Properties

Complexity:

674

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

553.202g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

554.083g/mol

Monoisotopic Mass:

553.202g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

78.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

Literature

Title	Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501