2-diphenylphosphanyl-6-methoxyphenol

C19H17O2P — CID 58759318

IUPAC2-diphenylphosphanyl-6-methoxyphenol
SMILESCOc1cccc(P(c2ccccc2)c2ccccc2)c1O
InChIInChI=1S/C19H17O2P/c1-21-17-13-8-14-18(19(17)20)22(15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-14,20H,1H3
InChIKeyFSURXWITBAQNTC-UHFFFAOYSA-N
MW308.32 g/mol
LogP3.16
Rot. Bonds4

About 2-diphenylphosphanyl-6-methoxyphenol

2-diphenylphosphanyl-6-methoxyphenol (PubChem CID 58759318) has the molecular formula C19H17O2P and a molecular weight of 308.32 g/mol. Its IUPAC name is 2-diphenylphosphanyl-6-methoxyphenol.

Molecular Properties

Compound Name2-diphenylphosphanyl-6-methoxyphenol
PubChem CID58759318
Molecular FormulaC19H17O2P
Molecular Weight308.32 g/mol
Exact Mass308.10
IUPAC Name2-diphenylphosphanyl-6-methoxyphenol
SMILESCOc1cccc(P(c2ccccc2)c2ccccc2)c1O
InChIInChI=1S/C19H17O2P/c1-21-17-13-8-14-18(19(17)20)22(15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-14,20H,1H3
InChIKeyFSURXWITBAQNTC-UHFFFAOYSA-N
XLogP3.16
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.32
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-diphenylphosphanyl-6-methoxyphenol?
The IUPAC name of 2-diphenylphosphanyl-6-methoxyphenol (CID 58759318) is 2-diphenylphosphanyl-6-methoxyphenol.
What is the SMILES notation for 2-diphenylphosphanyl-6-methoxyphenol?
The canonical SMILES for 2-diphenylphosphanyl-6-methoxyphenol is COc1cccc(P(c2ccccc2)c2ccccc2)c1O.
What is the InChIKey of 2-diphenylphosphanyl-6-methoxyphenol?
The InChIKey is FSURXWITBAQNTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17O2P/c1-21-17-13-8-14-18(19(17)20)22(15-9-4-2-5-10-15)16-11-6-3-7-12-16/h2-14,20H,1H3.
What are the key properties of 2-diphenylphosphanyl-6-methoxyphenol?
2-diphenylphosphanyl-6-methoxyphenol has a molecular weight of 308.32 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-diphenylphosphanyl-6-methoxyphenol is sourced from PubChem (CID 58759318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).