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CAS No.: | 56022-37-8 |
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Name: | ETHYLTRI-N-OCTYLPHOSPHONIUM BROMIDE |
Molecular Structure: | |
Formula: | C26H56BrP |
Molecular Weight: | 479.6006 |
Synonyms: | Ethyltrioctylphosphonium bromide;Phosphonium, ethyltrioctyl-, bromide; |
EINECS: | 259-948-0 |
PSA: | 13.59000 |
LogP: | 7.10940 |
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The Ethyl-trioctyl-phosphanium bromide, with the CAS registry number 56022-37-8, is also known as Phosphonium, ethyltrioctyl-, bromide (1:1). It belongs to the product category of Phosphonium Salts. Its EINECS registry number is 259-948-0. This chemical's molecular formula is C26H56BrP and molecular weight is 479.6006. What's more, its IUPAC name is Ethyl(trioctyl)phosphanium bromide.
Physical properties about Ethyl-trioctyl-phosphanium bromide are: (1)H-Bond Donor: 0; (2)H-Bond Acceptor: 1; (3)Rotatable Bond Count: 22; (4)Exact Mass: 478.330301; (5)MonoIsotopic Mass: 478.330301; (6)Topological Polar Surface Area: 0; (7)Heavy Atom Count: 28; (8)Formal Charge: 0; (9)Complexity: 233; (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: [Br-].[P+](CC)(CCCCCCCC)(CCCCCCCC)CCCCCCCC
(2) InChI: InChI=1/C26H56P.BrH/c1-5-9-12-15-18-21-24-27(8-4,25-22-19-16-13-10-6-2)26-23-20-17-14-11-7-3;/h5-26H2,1-4H3;1H/q+1;/p-1
(3) InChIKey: TUDUDQJRUPFUMA-REWHXWOFAI