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The Propyltriphenylphosphonium iodide, with CAS registry number 14350-50-6, has the systematic name of triphenyl(propyl)phosphonium iodide. And its IUPAC name is the same one. Besides this, it is also called phosphonium, triphenylpropyl-, iodide (1:1). And the chemical formula of this chemical is C21H22IP.
Physical properties about this chemical are: (1)H-Bond Donor: 0; (2)H-Bond Acceptor: 1; (3)Rotatable Bond Count: 5; (4)Exact Mass: 432.05038; (5)MonoIsotopic Mass: 432.05038; (6)Topological Polar Surface Area: 0; (7)Heavy Atom Count: 23; (8)Formal Charge: 0; (9)Complexity: 260; (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: 2.
You can still convert the following datas into molecular structure:
(1)SMILES: [I-].c1ccccc1[P+](c2ccccc2)(c3ccccc3)CCC
(2)InChI: InChI=1/C21H22P.HI/c1-2-18-22(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21;/h3-17H,2,18H2,1H3;1H/q+1;/p-1
(3)InChIKey: MPNQDJZRGAOBPW-REWHXWOFAP
(4)Std. InChI: InChI=1S/C21H22P.HI/c1-2-18-22(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21;/h3-17H,2,18H2,1H3;1H/q+1;/p-1
(5)Std. InChIKey: MPNQDJZRGAOBPW-UHFFFAOYSA-M
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