[diethoxy(methyl)silyl]-phenylmethanol

C12H20O3Si — CID 140892861

IUPAC[diethoxy(methyl)silyl]-phenylmethanol
SMILESCCO[Si](C)(OCC)C(O)c1ccccc1
InChIInChI=1S/C12H20O3Si/c1-4-14-16(3,15-5-2)12(13)11-9-7-6-8-10-11/h6-10,12-13H,4-5H2,1-3H3
InChIKeyPLBFHJUGHPNKCT-UHFFFAOYSA-N
MW240.37 g/mol
LogP2.40
Rot. Bonds6

About [diethoxy(methyl)silyl]-phenylmethanol

[diethoxy(methyl)silyl]-phenylmethanol (PubChem CID 140892861) has the molecular formula C12H20O3Si and a molecular weight of 240.37 g/mol. Its IUPAC name is [diethoxy(methyl)silyl]-phenylmethanol.

Molecular Properties

Compound Name[diethoxy(methyl)silyl]-phenylmethanol
PubChem CID140892861
Molecular FormulaC12H20O3Si
Molecular Weight240.37 g/mol
Exact Mass240.12
IUPAC Name[diethoxy(methyl)silyl]-phenylmethanol
SMILESCCO[Si](C)(OCC)C(O)c1ccccc1
InChIInChI=1S/C12H20O3Si/c1-4-14-16(3,15-5-2)12(13)11-9-7-6-8-10-11/h6-10,12-13H,4-5H2,1-3H3
InChIKeyPLBFHJUGHPNKCT-UHFFFAOYSA-N
XLogP2.40
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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 [diethoxy(methyl)silyl]-phenylmethanol?
The IUPAC name of [diethoxy(methyl)silyl]-phenylmethanol (CID 140892861) is [diethoxy(methyl)silyl]-phenylmethanol.
What is the SMILES notation for [diethoxy(methyl)silyl]-phenylmethanol?
The canonical SMILES for [diethoxy(methyl)silyl]-phenylmethanol is CCO[Si](C)(OCC)C(O)c1ccccc1.
What is the InChIKey of [diethoxy(methyl)silyl]-phenylmethanol?
The InChIKey is PLBFHJUGHPNKCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O3Si/c1-4-14-16(3,15-5-2)12(13)11-9-7-6-8-10-11/h6-10,12-13H,4-5H2,1-3H3.
What are the key properties of [diethoxy(methyl)silyl]-phenylmethanol?
[diethoxy(methyl)silyl]-phenylmethanol has a molecular weight of 240.37 g/mol, XLogP of 2.40, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [diethoxy(methyl)silyl]-phenylmethanol is sourced from PubChem (CID 140892861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).