1-phenyl-2-tri(propan-2-yl)silyloxyethanol

C17H30O2Si — CID 85273419

IUPAC1-phenyl-2-tri(propan-2-yl)silyloxyethanol
SMILESCC(C)[Si](OCC(O)c1ccccc1)(C(C)C)C(C)C
InChIInChI=1S/C17H30O2Si/c1-13(2)20(14(3)4,15(5)6)19-12-17(18)16-10-8-7-9-11-16/h7-11,13-15,17-18H,12H2,1-6H3
InChIKeyQMDWTSORPLPYNI-UHFFFAOYSA-N
MW294.51 g/mol
LogP4.91
Rot. Bonds7

About 1-phenyl-2-tri(propan-2-yl)silyloxyethanol

1-phenyl-2-tri(propan-2-yl)silyloxyethanol (PubChem CID 85273419) has the molecular formula C17H30O2Si and a molecular weight of 294.51 g/mol. Its IUPAC name is 1-phenyl-2-tri(propan-2-yl)silyloxyethanol.

Molecular Properties

Compound Name1-phenyl-2-tri(propan-2-yl)silyloxyethanol
PubChem CID85273419
Molecular FormulaC17H30O2Si
Molecular Weight294.51 g/mol
Exact Mass294.20
IUPAC Name1-phenyl-2-tri(propan-2-yl)silyloxyethanol
SMILESCC(C)[Si](OCC(O)c1ccccc1)(C(C)C)C(C)C
InChIInChI=1S/C17H30O2Si/c1-13(2)20(14(3)4,15(5)6)19-12-17(18)16-10-8-7-9-11-16/h7-11,13-15,17-18H,12H2,1-6H3
InChIKeyQMDWTSORPLPYNI-UHFFFAOYSA-N
XLogP4.91
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.51
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-tri(propan-2-yl)silyloxyethanol?
The IUPAC name of 1-phenyl-2-tri(propan-2-yl)silyloxyethanol (CID 85273419) is 1-phenyl-2-tri(propan-2-yl)silyloxyethanol.
What is the SMILES notation for 1-phenyl-2-tri(propan-2-yl)silyloxyethanol?
The canonical SMILES for 1-phenyl-2-tri(propan-2-yl)silyloxyethanol is CC(C)[Si](OCC(O)c1ccccc1)(C(C)C)C(C)C.
What is the InChIKey of 1-phenyl-2-tri(propan-2-yl)silyloxyethanol?
The InChIKey is QMDWTSORPLPYNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30O2Si/c1-13(2)20(14(3)4,15(5)6)19-12-17(18)16-10-8-7-9-11-16/h7-11,13-15,17-18H,12H2,1-6H3.
What are the key properties of 1-phenyl-2-tri(propan-2-yl)silyloxyethanol?
1-phenyl-2-tri(propan-2-yl)silyloxyethanol has a molecular weight of 294.51 g/mol, XLogP of 4.91, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-tri(propan-2-yl)silyloxyethanol is sourced from PubChem (CID 85273419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).