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114290-38-9 | Phosphonium, tributylhexadecyl-, acetate (9CI)
CAS No: 114290-38-9 Catalog No: AG000AZC MDL No:
Product Description
Catalog Number:
AG000AZC
Chemical Name:
Phosphonium, tributylhexadecyl-, acetate (9CI)
CAS Number:
114290-38-9
Molecular Formula:
C30H63O2P
Molecular Weight:
486.7938
IUPAC Name:
tributyl(hexadecyl)phosphanium;acetate
InChI:
InChI=1S/C28H60P.C2H4O2/c1-5-9-13-14-15-16-17-18-19-20-21-22-23-24-28-29(25-10-6-2,26-11-7-3)27-12-8-4;1-2(3)4/h5-28H2,1-4H3;1H3,(H,3,4)/q+1;/p-1
InChI Key:
OGTSMXPCOACGJP-UHFFFAOYSA-M
SMILES:
[O-]C(=O)C.CCCCCCCCCCCCCCCC[P+](CCCC)(CCCC)CCCC
Properties
Complexity:
302
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
486.457g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
486.806g/mol
Monoisotopic Mass:
486.457g/mol
Rotatable Bond Count:
24
Topological Polar Surface Area:
40.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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