3-tri(propan-2-yl)silyloxypropan-1-ol

C12H28O2Si — CID 11287724

IUPAC3-tri(propan-2-yl)silyloxypropan-1-ol
SMILESCC(C)[Si](OCCCO)(C(C)C)C(C)C
InChIInChI=1S/C12H28O2Si/c1-10(2)15(11(3)4,12(5)6)14-9-7-8-13/h10-13H,7-9H2,1-6H3
InChIKeyALAZQHUMRPXUEN-UHFFFAOYSA-N
MW232.44 g/mol
LogP3.56
Rot. Bonds7

About 3-tri(propan-2-yl)silyloxypropan-1-ol

3-tri(propan-2-yl)silyloxypropan-1-ol (PubChem CID 11287724) has the molecular formula C12H28O2Si and a molecular weight of 232.44 g/mol. Its IUPAC name is 3-tri(propan-2-yl)silyloxypropan-1-ol.

Molecular Properties

Compound Name3-tri(propan-2-yl)silyloxypropan-1-ol
PubChem CID11287724
Molecular FormulaC12H28O2Si
Molecular Weight232.44 g/mol
Exact Mass232.19
IUPAC Name3-tri(propan-2-yl)silyloxypropan-1-ol
SMILESCC(C)[Si](OCCCO)(C(C)C)C(C)C
InChIInChI=1S/C12H28O2Si/c1-10(2)15(11(3)4,12(5)6)14-9-7-8-13/h10-13H,7-9H2,1-6H3
InChIKeyALAZQHUMRPXUEN-UHFFFAOYSA-N
XLogP3.56
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.44
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-tri(propan-2-yl)silyloxypropan-1-ol?
The IUPAC name of 3-tri(propan-2-yl)silyloxypropan-1-ol (CID 11287724) is 3-tri(propan-2-yl)silyloxypropan-1-ol.
What is the SMILES notation for 3-tri(propan-2-yl)silyloxypropan-1-ol?
The canonical SMILES for 3-tri(propan-2-yl)silyloxypropan-1-ol is CC(C)[Si](OCCCO)(C(C)C)C(C)C.
What is the InChIKey of 3-tri(propan-2-yl)silyloxypropan-1-ol?
The InChIKey is ALAZQHUMRPXUEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O2Si/c1-10(2)15(11(3)4,12(5)6)14-9-7-8-13/h10-13H,7-9H2,1-6H3.
What are the key properties of 3-tri(propan-2-yl)silyloxypropan-1-ol?
3-tri(propan-2-yl)silyloxypropan-1-ol has a molecular weight of 232.44 g/mol, XLogP of 3.56, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tri(propan-2-yl)silyloxypropan-1-ol is sourced from PubChem (CID 11287724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).