2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol

C14H24O2Si — CID 11780000

IUPAC2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol
SMILESCC(C)(C)[Si](C)(C)OC(CO)c1ccccc1
InChIInChI=1S/C14H24O2Si/c1-14(2,3)17(4,5)16-13(11-15)12-9-7-6-8-10-12/h6-10,13,15H,11H2,1-5H3
InChIKeyMDPRSLQIQPQRGN-UHFFFAOYSA-N
MW252.43 g/mol
LogP3.74
Rot. Bonds4

About 2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol

2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol (PubChem CID 11780000) has the molecular formula C14H24O2Si and a molecular weight of 252.43 g/mol. Its IUPAC name is 2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol.

Molecular Properties

Compound Name2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol
PubChem CID11780000
Molecular FormulaC14H24O2Si
Molecular Weight252.43 g/mol
Exact Mass252.15
IUPAC Name2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol
SMILESCC(C)(C)[Si](C)(C)OC(CO)c1ccccc1
InChIInChI=1S/C14H24O2Si/c1-14(2,3)17(4,5)16-13(11-15)12-9-7-6-8-10-12/h6-10,13,15H,11H2,1-5H3
InChIKeyMDPRSLQIQPQRGN-UHFFFAOYSA-N
XLogP3.74
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.43
LogP ≤ 53.74
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 2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol?
The IUPAC name of 2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol (CID 11780000) is 2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol.
What is the SMILES notation for 2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol?
The canonical SMILES for 2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol is CC(C)(C)[Si](C)(C)OC(CO)c1ccccc1.
What is the InChIKey of 2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol?
The InChIKey is MDPRSLQIQPQRGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2Si/c1-14(2,3)17(4,5)16-13(11-15)12-9-7-6-8-10-12/h6-10,13,15H,11H2,1-5H3.
What are the key properties of 2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol?
2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol has a molecular weight of 252.43 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl(dimethyl)silyl]oxy-2-phenylethanol is sourced from PubChem (CID 11780000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).