tris(nonylphenyl) phosphate - CAS 26569-53-9
Catalog:
BB050413
Product Name:
tris(nonylphenyl) phosphate
CAS:
26569-53-9
Synonyms:
Phenol, nonyl-, phosphate (3:1)
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BB050413
100 mg
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IUPAC Name: tris(2-nonylphenyl) phosphate
Description: tris(nonylphenyl) phosphate (CAS# 26569-53-9 ) is a useful research chemical.
Molecular Weight: 705.01
Molecular Formula: C45H69O4P
Canonical SMILES: CCCCCCCCCC1=CC=CC=C1OP(=O)(OC2=CC=CC=C2CCCCCCCCC)OC3=CC=CC=C3CCCCCCCCC
InChI: InChI=1S/C45H69O4P/c1-4-7-10-13-16-19-22-31-40-34-25-28-37-43(40)47-50(46,48-44-38-29-26-35-41(44)32-23-20-17-14-11-8-5-2)49-45-39-30-27-36-42(45)33-24-21-18-15-12-9-6-3/h25-30,34-39H,4-24,31-33H2,1-3H3
InChI Key: OOZBTDPWFHJVEK-UHFFFAOYSA-N
Boiling Point: 707.7 °C at 760 mmHg
Density: 1.002 g/cm3
Complexity: 729
Compound Is Canonicalized: Yes
Covalently-Bonded Unit Count: 1
Defined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Exact Mass: 704.49334768
Formal Charge: 0
Heavy Atom Count: 50
Hydrogen Bond Acceptor Count: 4
Hydrogen Bond Donor Count: 0
Isotope Atom Count: 0
Monoisotopic Mass: 704.49334768
Rotatable Bond Count: 30
Topological Polar Surface Area: 44.8
Undefined Atom Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
XLogP3: 18.7
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