3,5-Bis(isopropyl)phenyl Diphenyl Phosphate - CAS 113765-39-2
Catalog: |
BB061796 |
Product Name: |
3,5-Bis(isopropyl)phenyl Diphenyl Phosphate |
CAS: |
113765-39-2 |
Synonyms: |
3,5-Bis(isopropyl)phenyl Diphenyl Phosphate; [3,5-di(propan-2-yl)phenyl] diphenyl phosphate; 3,5-Di(propan-2-yl)phenyl diphenyl phosphate |
IUPAC Name: | [3,5-di(propan-2-yl)phenyl] diphenyl phosphate |
Molecular Weight: | 410.44 |
Molecular Formula: | C24H27O4P |
Canonical SMILES: | CC(C)C1=CC(=CC(=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3)C(C)C |
InChI: | InChI=1S/C24H27O4P/c1-18(2)20-15-21(19(3)4)17-24(16-20)28-29(25,26-22-11-7-5-8-12-22)27-23-13-9-6-10-14-23/h5-19H,1-4H3 |
InChI Key: | PYIXRBAUGAEEEW-UHFFFAOYSA-N |
Complexity: | 483 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 410.16469634 |
Formal Charge: | 0 |
Heavy Atom Count: | 29 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 410.16469634 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 44.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 7.2 |
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