Tris(isopropylphenyl)phosphate

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Catalog Number
ACM64532952-1
Product Name
Tris(isopropylphenyl)phosphate
Structure
Structure
CAS
64532-95-2
Category
Heterocyclic Organic Compound
Synonyms
Tris(2-isopropylphenyl) phosphate
IUPAC Name
Tris(2-propan-2-ylphenyl) phosphate
Molecular Weight
452.5
Molecular Formula
C27H33O4P
Canonical SMILES
CC(C)C1=CC=CC=C1OP(=O)(OC2=CC=CC=C2C(C)C)OC3=CC=CC=C3C(C)C
InChI
InChI=1S/C27H33O4P/c1-19(2)22-13-7-10-16-25(22)29-32(28,30-26-17-11-8-14-23(26)20(3)4)31-27-18-12-9-15-24(27)21(5)6/h7-21H,1-6H3
InChI Key
LIPMRGQQBZJCTM-UHFFFAOYSA-N
Boiling Point
494.1±44.0 °C
Density
1.108±0.06 g/cm3
Complexity
524
Covalently-Bonded Unit Count
1
Defined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Exact Mass
452.21164653
Formal Charge
0
Heavy Atom Count
32
Hydrogen Bond Acceptor Count
4
Hydrogen Bond Donor Count
0
Isotope Atom Count
0
Monoisotopic Mass
452.21164653
Physical State
Solid
Rotatable Bond Count
9
Topological Polar Surface Area
44.8 Ų
Undefined Atom Stereocenter Count
0
Undefined Bond Stereocenter Count
0
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