2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol

C17H23O2PSi — CID 23082280

IUPAC2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol
SMILESCc1cccc(P(c2cccc(C)c2O)[Si](C)(C)C)c1O
InChIInChI=1S/C17H23O2PSi/c1-12-8-6-10-14(16(12)18)20(21(3,4)5)15-11-7-9-13(2)17(15)19/h6-11,18-19H,1-5H3
InChIKeyNYXWJSSODHEGFV-UHFFFAOYSA-N
MW318.43 g/mol
LogP3.98
Rot. Bonds3

About 2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol

2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol (PubChem CID 23082280) has the molecular formula C17H23O2PSi and a molecular weight of 318.43 g/mol. Its IUPAC name is 2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol.

Molecular Properties

Compound Name2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol
PubChem CID23082280
Molecular FormulaC17H23O2PSi
Molecular Weight318.43 g/mol
Exact Mass318.12
IUPAC Name2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol
SMILESCc1cccc(P(c2cccc(C)c2O)[Si](C)(C)C)c1O
InChIInChI=1S/C17H23O2PSi/c1-12-8-6-10-14(16(12)18)20(21(3,4)5)15-11-7-9-13(2)17(15)19/h6-11,18-19H,1-5H3
InChIKeyNYXWJSSODHEGFV-UHFFFAOYSA-N
XLogP3.98
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.43
LogP ≤ 53.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol?
The IUPAC name of 2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol (CID 23082280) is 2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol.
What is the SMILES notation for 2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol?
The canonical SMILES for 2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol is Cc1cccc(P(c2cccc(C)c2O)[Si](C)(C)C)c1O.
What is the InChIKey of 2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol?
The InChIKey is NYXWJSSODHEGFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23O2PSi/c1-12-8-6-10-14(16(12)18)20(21(3,4)5)15-11-7-9-13(2)17(15)19/h6-11,18-19H,1-5H3.
What are the key properties of 2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol?
2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol has a molecular weight of 318.43 g/mol, XLogP of 3.98, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-hydroxy-3-methylphenyl)-trimethylsilylphosphanyl]-6-methylphenol is sourced from PubChem (CID 23082280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).