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86864-95-1 | PHOSPHORIC ACID 2,4-DIMETHYLPHENYL BIS(2,4,6-TRIMETHYLPHENYL) ESTER
CAS No: 86864-95-1 Catalog No: AG004ILC MDL No:
Product Description
Catalog Number:
AG004ILC
Chemical Name:
PHOSPHORIC ACID 2,4-DIMETHYLPHENYL BIS(2,4,6-TRIMETHYLPHENYL) ESTER
CAS Number:
86864-95-1
Molecular Formula:
C26H31O4P
Molecular Weight:
438.4957
IUPAC Name:
(2,4-dimethylphenyl) bis(2,4,6-trimethylphenyl) phosphate
InChI:
InChI=1S/C26H31O4P/c1-16-9-10-24(19(4)11-16)28-31(27,29-25-20(5)12-17(2)13-21(25)6)30-26-22(7)14-18(3)15-23(26)8/h9-15H,1-8H3
InChI Key:
RBYUVXNRQIGHLL-UHFFFAOYSA-N
SMILES:
Cc1ccc(c(c1)C)OP(=O)(Oc1c(C)cc(cc1C)C)Oc1c(C)cc(cc1C)C
Properties
Complexity:
565
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
438.196g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
438.504g/mol
Monoisotopic Mass:
438.196g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.9
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