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138311-43-0 | Propanoic acid, 3-[[(2-ethylhexyl)oxy]phosphinyl]-, 2-ethylhexyl ester
CAS No: 138311-43-0 Catalog No: AG0018JD MDL No:
Product Description
Catalog Number:
AG0018JD
Chemical Name:
Propanoic acid, 3-[[(2-ethylhexyl)oxy]phosphinyl]-, 2-ethylhexyl ester
CAS Number:
138311-43-0
Molecular Formula:
C19H39O4P
Molecular Weight:
362.4843
IUPAC Name:
2-ethylhexoxy-[3-(2-ethylhexoxy)-3-oxopropyl]-oxophosphanium
InChI:
InChI=1S/C19H38O4P/c1-5-9-11-17(7-3)15-22-19(20)13-14-24(21)23-16-18(8-4)12-10-6-2/h17-18H,5-16H2,1-4H3/q+1
InChI Key:
KIIQHGYRALSMOT-UHFFFAOYSA-N
SMILES:
CCCCC(COC(=O)CCP(=O)OCC(CCCC)CC)CC
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.251g/mol
Formal Charge:
1
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
361.483g/mol
Monoisotopic Mass:
361.251g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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