| CAS Number | 745052-92-0 |
| Catalog Number | AG00FBFN(AGN-PC-035QLZ) |
| Chemical Name | Triphenyl[(tetrahydro-2H-pyran-4-yl)methyl]phosphonium iodide |
| EC Number | 616-106-0 |
| IUPAC Name | oxan-4-ylmethyl(triphenyl)phosphanium;iodide |
| InChI | InChI=1S/C24H26OP.HI/c1-4-10-22(11-5-1)26(23-12-6-2-7-13-23,24-14-8-3-9-15-24)20-21-16-18-25-19-17-21;/h1-15,21H,16-20H2;1H/q+1;/p-1 |
| InChI Key | XJEMHAHSQBWRGG-UHFFFAOYSA-M |
| MDL Number | MFCD14706698 |
| Molecular Formula | C24H26IOP |
| Molecular Weight | 488.3409 |
| SMILES | c1ccc(cc1)[P+](CC2CCOCC2)(c3ccccc3)c4ccccc4.[I-] |
| Synonyms | 745052-92-0,
Triphenyl[(tetrahydro-2H-pyran-4-yl)methyl]phosphonium iodide,
Triphenyl((tetrahydro-2H-pyran-4-yl)methyl)phosphonium iodide,
Phosphonium, triphenyl[(tetrahydro-2H-pyran-4-yl)methyl]-, iodide,
SCHEMBL2414352,
Triphenyl(tetrahydropyran-4-ylmethyl)phosphonium iodide,
iodotriphenyl((tetrahydro-2H-pyran-4-yl)methyl)phosphorane,
XJEMHAHSQBWRGG-UHFFFAOYSA-M,
AKOS028110003,
DB-012590,
(Oxan-4-ylmethyl)triphenylphosphanium iodide,
CS-0028235,
FT-0763790,
J-650327,
triphenyl(tetrahydropyran-4-ylmethyl)-phosphonium iodide,
triphenyl(tetrahydro-2H-pyran-4-ylmethyl)phosphonium iodide,
triphenyl(tetrahydro-2H-pyran-4-yl-methyl)phosphonium iodide,
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| Complexity | 353 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 488.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 27 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 488.349g/mol |
| Monoisotopic Mass | 488.077g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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