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67688-38-4 | Phosphonium, (2-ethoxy-1,3-pentadienyl)triphenyl-, iodide
CAS No: 67688-38-4 Catalog No: AG005QM3 MDL No:
Product Description
Catalog Number:
AG005QM3
Chemical Name:
Phosphonium, (2-ethoxy-1,3-pentadienyl)triphenyl-, iodide
CAS Number:
67688-38-4
Molecular Formula:
C25H26IOP
Molecular Weight:
500.3516
IUPAC Name:
2-ethoxypenta-1,3-dienyl(triphenyl)phosphanium;iodide
InChI:
InChI=1S/C25H26OP.HI/c1-3-14-22(26-4-2)21-27(23-15-8-5-9-16-23,24-17-10-6-11-18-24)25-19-12-7-13-20-25;/h3,5-21H,4H2,1-2H3;1H/q+1;/p-1
InChI Key:
GBYFOFTTYJJVFT-UHFFFAOYSA-M
SMILES:
CCOC(=C[P+](c1ccccc1)(c1ccccc1)c1ccccc1)C=CC.[I-]
Properties
Complexity:
431
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
500.077g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
500.36g/mol
Monoisotopic Mass:
500.077g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
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