2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol

C18H12F3O3P — CID 15782313

IUPAC2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol
SMILESOc1cccc(F)c1P(c1c(O)cccc1F)c1c(O)cccc1F
InChIInChI=1S/C18H12F3O3P/c19-10-4-1-7-13(22)16(10)25(17-11(20)5-2-8-14(17)23)18-12(21)6-3-9-15(18)24/h1-9,22-24H
InChIKeyWDZDAXXRGDJCPK-UHFFFAOYSA-N
MW364.26 g/mol
LogP2.98
Rot. Bonds3

About 2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol

2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol (PubChem CID 15782313) has the molecular formula C18H12F3O3P and a molecular weight of 364.26 g/mol. Its IUPAC name is 2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol.

Molecular Properties

Compound Name2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol
PubChem CID15782313
Molecular FormulaC18H12F3O3P
Molecular Weight364.26 g/mol
Exact Mass364.05
IUPAC Name2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol
SMILESOc1cccc(F)c1P(c1c(O)cccc1F)c1c(O)cccc1F
InChIInChI=1S/C18H12F3O3P/c19-10-4-1-7-13(22)16(10)25(17-11(20)5-2-8-14(17)23)18-12(21)6-3-9-15(18)24/h1-9,22-24H
InChIKeyWDZDAXXRGDJCPK-UHFFFAOYSA-N
XLogP2.98
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.26
LogP ≤ 52.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

tris(2,6-difluorophenyl)phosphane
CID 15876355
dibromo-(2,6-difluorophenyl)phosphane
CID 23135564
bis(2,6-difluorophenyl)-phenylphosphane
CID 15876354
(2,6-difluorophenyl)-diphenylphosphane
CID 15876353
CID 155164288
CID 155164288
bis(2,6-difluorophenol);zirconium
CID 161409047
2,6-difluorophenol;2-fluorophenol
CID 160898350
2,3-difluorophenol;2,3,5,6-tetrafluorobenzene-1,4-diol
CID 174546410
bis(2-fluorophenol);zirconium(2+);dichloride
CID 174353098
3-fluoro-2-(pentafluoro-λ6-sulfanyl)phenol
CID 140521626
CID 95476507
CID 95476507
2-(2,6-difluorophenyl)-1,3-difluorobenzene
CID 13068684

Frequently Asked Questions

What is the IUPAC name of 2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol?
The IUPAC name of 2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol (CID 15782313) is 2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol.
What is the SMILES notation for 2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol?
The canonical SMILES for 2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol is Oc1cccc(F)c1P(c1c(O)cccc1F)c1c(O)cccc1F.
What is the InChIKey of 2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol?
The InChIKey is WDZDAXXRGDJCPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F3O3P/c19-10-4-1-7-13(22)16(10)25(17-11(20)5-2-8-14(17)23)18-12(21)6-3-9-15(18)24/h1-9,22-24H.
What are the key properties of 2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol?
2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol has a molecular weight of 364.26 g/mol, XLogP of 2.98, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bis(2-fluoro-6-hydroxyphenyl)phosphanyl-3-fluorophenol is sourced from PubChem (CID 15782313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).