2-tri(propan-2-yl)silylethane-1,1-diol

C11H26O2Si — CID 87898785

IUPAC2-tri(propan-2-yl)silylethane-1,1-diol
SMILESCC(C)[Si](CC(O)O)(C(C)C)C(C)C
InChIInChI=1S/C11H26O2Si/c1-8(2)14(9(3)4,10(5)6)7-11(12)13/h8-13H,7H2,1-6H3
InChIKeyGGZHQXDWQKIKTA-UHFFFAOYSA-N
MW218.41 g/mol
LogP2.98
Rot. Bonds5

About 2-tri(propan-2-yl)silylethane-1,1-diol

2-tri(propan-2-yl)silylethane-1,1-diol (PubChem CID 87898785) has the molecular formula C11H26O2Si and a molecular weight of 218.41 g/mol. Its IUPAC name is 2-tri(propan-2-yl)silylethane-1,1-diol.

Molecular Properties

Compound Name2-tri(propan-2-yl)silylethane-1,1-diol
PubChem CID87898785
Molecular FormulaC11H26O2Si
Molecular Weight218.41 g/mol
Exact Mass218.17
IUPAC Name2-tri(propan-2-yl)silylethane-1,1-diol
SMILESCC(C)[Si](CC(O)O)(C(C)C)C(C)C
InChIInChI=1S/C11H26O2Si/c1-8(2)14(9(3)4,10(5)6)7-11(12)13/h8-13H,7H2,1-6H3
InChIKeyGGZHQXDWQKIKTA-UHFFFAOYSA-N
XLogP2.98
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.41
LogP ≤ 52.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-tri(propan-2-yl)silylethane-1,1-diol?
The IUPAC name of 2-tri(propan-2-yl)silylethane-1,1-diol (CID 87898785) is 2-tri(propan-2-yl)silylethane-1,1-diol.
What is the SMILES notation for 2-tri(propan-2-yl)silylethane-1,1-diol?
The canonical SMILES for 2-tri(propan-2-yl)silylethane-1,1-diol is CC(C)[Si](CC(O)O)(C(C)C)C(C)C.
What is the InChIKey of 2-tri(propan-2-yl)silylethane-1,1-diol?
The InChIKey is GGZHQXDWQKIKTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26O2Si/c1-8(2)14(9(3)4,10(5)6)7-11(12)13/h8-13H,7H2,1-6H3.
What are the key properties of 2-tri(propan-2-yl)silylethane-1,1-diol?
2-tri(propan-2-yl)silylethane-1,1-diol has a molecular weight of 218.41 g/mol, XLogP of 2.98, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tri(propan-2-yl)silylethane-1,1-diol is sourced from PubChem (CID 87898785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).