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114045-02-2 | Phosphinic acid, (2-ethylhexyl)-, 2-ethylhexyl ester (9CI)
CAS No: 114045-02-2 Catalog No: AG000AE2 MDL No:
Product Description
Catalog Number:
AG000AE2
Chemical Name:
Phosphinic acid, (2-ethylhexyl)-, 2-ethylhexyl ester (9CI)
CAS Number:
114045-02-2
Molecular Formula:
C16H35O2P
Molecular Weight:
290.4217
IUPAC Name:
2-ethylhexoxy-(2-ethylhexyl)-oxophosphanium
InChI:
InChI=1S/C16H34O2P/c1-5-9-11-15(7-3)13-18-19(17)14-16(8-4)12-10-6-2/h15-16H,5-14H2,1-4H3/q+1
InChI Key:
YHZUKKGGOYXZHV-UHFFFAOYSA-N
SMILES:
CCCCC(COP(=O)CC(CCCC)CC)CC
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.23g/mol
Formal Charge:
1
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
289.42g/mol
Monoisotopic Mass:
289.23g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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