tris(4-fluorophenyl)methanol

C19H13F3O — CID 2778005

IUPACtris(4-fluorophenyl)methanol
SMILESOC(c1ccc(F)cc1)(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C19H13F3O/c20-16-7-1-13(2-8-16)19(23,14-3-9-17(21)10-4-14)15-5-11-18(22)12-6-15/h1-12,23H
InChIKeyJALVMPWRAMMHQY-UHFFFAOYSA-N
MW314.31 g/mol
LogP4.39
Rot. Bonds3

About tris(4-fluorophenyl)methanol

tris(4-fluorophenyl)methanol (PubChem CID 2778005) has the molecular formula C19H13F3O and a molecular weight of 314.31 g/mol. Its IUPAC name is tris(4-fluorophenyl)methanol.

Molecular Properties

Compound Nametris(4-fluorophenyl)methanol
PubChem CID2778005
Molecular FormulaC19H13F3O
Molecular Weight314.31 g/mol
Exact Mass314.09
IUPAC Nametris(4-fluorophenyl)methanol
SMILESOC(c1ccc(F)cc1)(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C19H13F3O/c20-16-7-1-13(2-8-16)19(23,14-3-9-17(21)10-4-14)15-5-11-18(22)12-6-15/h1-12,23H
InChIKeyJALVMPWRAMMHQY-UHFFFAOYSA-N
XLogP4.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.31
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tris(4-fluorophenyl)methanol?
The IUPAC name of tris(4-fluorophenyl)methanol (CID 2778005) is tris(4-fluorophenyl)methanol.
What is the SMILES notation for tris(4-fluorophenyl)methanol?
The canonical SMILES for tris(4-fluorophenyl)methanol is OC(c1ccc(F)cc1)(c1ccc(F)cc1)c1ccc(F)cc1.
What is the InChIKey of tris(4-fluorophenyl)methanol?
The InChIKey is JALVMPWRAMMHQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13F3O/c20-16-7-1-13(2-8-16)19(23,14-3-9-17(21)10-4-14)15-5-11-18(22)12-6-15/h1-12,23H.
What are the key properties of tris(4-fluorophenyl)methanol?
tris(4-fluorophenyl)methanol has a molecular weight of 314.31 g/mol, XLogP of 4.39, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tris(4-fluorophenyl)methanol is sourced from PubChem (CID 2778005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).