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12365-92-3

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Basic Information
CAS No.: 12365-92-3
Name: 4,7-Dichloroquinolinium tribromide
Molecular Structure:
Molecular Structure of 12365-92-3 (4,7-Dichloroquinolinium tribromide)
Formula: C9H6Br3Cl2N
Molecular Weight: 438.76864
Synonyms: 4, 7-Dichloroquinolin-1-ium tribromide;
EINECS: 235-612-9
PSA: 0.00000
LogP: 0.00000
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Specification

The 4, 7-Dichloroquinolinium tribromide, with the CAS registry number of 12365-92-3, is also known as 4, 7-Dichloroquinolinium bromide-bromine (1:1). Its EINECS registry number is 235-612-9. This chemical's molecular formula is C9H6Br3Cl2N and molecular weight is 438.76864. What's more, its IUPAC name is 4, 7-Dichloroquinolin-1-ium tribromide.

Physical properties about 4, 7-Dichloroquinolinium tribromide are: (1)H-Bond Donor: 1; (2)H-Bond Acceptor: 3; (3)Rotatable Bond Count: 0; (4)Exact Mass: 436.740696; (5)MonoIsotopic Mass: 434.742742; (6)Topological Polar Surface Area: 14.1; (7)Heavy Atom Count: 15; (8)Formal Charge: -2; (9)Complexity: 163; (10)Isotope Atom Count: 0; (11)Defined Atom StereoCenter Count: 0; (12)Undefined Atom StereoCenter Count: 0; (13)Defined Bond StereoCenter Count: 0; (14)Undefined Bond StereoCenter Count: 0; (15)Covalently-Bonded Unit Count: 4.

You can still convert the following datas into molecular structure:
(1) SMILES: [Br-].BrBr.Clc1cc2[nH+]ccc(Cl)c2cc1
(2) InChI: InChI=1/C9H5Cl2N.Br2.BrH/c10-6-1-2-7-8(11)3-4-12-9(7)5-6;1-2;/h1-5H;;1H
(3) InChIKey: VRAXPQRACCUGTD-UHFFFAOYAY