2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol

C19H17O4P — CID 142850467

IUPAC2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol
SMILESOc1ccccc1COPOc1ccccc1-c1ccccc1O
InChIInChI=1S/C19H17O4P/c20-17-10-4-1-7-14(17)13-22-24-23-19-12-6-3-9-16(19)15-8-2-5-11-18(15)21/h1-12,20-21,24H,13H2
InChIKeyRYWOATQVIKGXQH-UHFFFAOYSA-N
MW340.32 g/mol
LogP4.87
Rot. Bonds6

About 2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol

2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol (PubChem CID 142850467) has the molecular formula C19H17O4P and a molecular weight of 340.32 g/mol. Its IUPAC name is 2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol.

Molecular Properties

Compound Name2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol
PubChem CID142850467
Molecular FormulaC19H17O4P
Molecular Weight340.32 g/mol
Exact Mass340.09
IUPAC Name2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol
SMILESOc1ccccc1COPOc1ccccc1-c1ccccc1O
InChIInChI=1S/C19H17O4P/c20-17-10-4-1-7-14(17)13-22-24-23-19-12-6-3-9-16(19)15-8-2-5-11-18(15)21/h1-12,20-21,24H,13H2
InChIKeyRYWOATQVIKGXQH-UHFFFAOYSA-N
XLogP4.87
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.32
LogP ≤ 54.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol?
The IUPAC name of 2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol (CID 142850467) is 2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol.
What is the SMILES notation for 2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol?
The canonical SMILES for 2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol is Oc1ccccc1COPOc1ccccc1-c1ccccc1O.
What is the InChIKey of 2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol?
The InChIKey is RYWOATQVIKGXQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17O4P/c20-17-10-4-1-7-14(17)13-22-24-23-19-12-6-3-9-16(19)15-8-2-5-11-18(15)21/h1-12,20-21,24H,13H2.
What are the key properties of 2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol?
2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol has a molecular weight of 340.32 g/mol, XLogP of 4.87, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-hydroxyphenyl)phenoxy]phosphanyloxymethyl]phenol is sourced from PubChem (CID 142850467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).