Phosphorous acid trioleyl ester

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Catalog Number
ACM13023137-2
Product Name
Phosphorous acid trioleyl ester
Structure
Structure
CAS
13023-13-7
Category
Heterocyclic Organic Compound
Synonyms
Trioctadec-9-en-1-yl phosphite
IUPAC Name
Tris(octadec-9-enyl) phosphite
Molecular Weight
833.4
Molecular Formula
C54H105O3P
Canonical SMILES
CCCCCCCCC=CCCCCCCCCOP(OCCCCCCCCC=CCCCCCCCC)OCCCCCCCCC=CCCCCCCCC
InChI
InChI=1S/C54H105O3P/c1-4-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49-52-55-58(56-53-50-47-44-41-38-35-32-29-26-23-20-17-14-11-8-5-2)57-54-51-48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-3/h25-30H,4-24,31-54H2,1-3H3
InChI Key
QULKPMBZSVVAJM-UHFFFAOYSA-N
Boiling Point
783.0±59.0 °C
Flash Point
225 °C
Density
0.88 g/mL
Complexity
706
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
832.7801342
Formal Charge
0
Heavy Atom Count
58
Hydrogen Bond Acceptor Count
3
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
832.7801342
Rotatable Bond Count
51
Topological Polar Surface Area
27.7 Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
3
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