2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethylbutan-1-ol

C13H30O2Si — CID 19599358

IUPAC2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethylbutan-1-ol
SMILESCCC(CC)(CO)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H30O2Si/c1-8-13(9-2,10-14)11-15-16(6,7)12(3,4)5/h14H,8-11H2,1-7H3
InChIKeyYIVKEFJJAHHWHO-UHFFFAOYSA-N
MW246.47 g/mol
LogP3.81
Rot. Bonds6

About 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethylbutan-1-ol

2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethylbutan-1-ol (PubChem CID 19599358) has the molecular formula C13H30O2Si and a molecular weight of 246.47 g/mol. Its IUPAC name is 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethylbutan-1-ol.

Molecular Properties

Compound Name2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethylbutan-1-ol
PubChem CID19599358
Molecular FormulaC13H30O2Si
Molecular Weight246.47 g/mol
Exact Mass246.20
IUPAC Name2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethylbutan-1-ol
SMILESCCC(CC)(CO)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H30O2Si/c1-8-13(9-2,10-14)11-15-16(6,7)12(3,4)5/h14H,8-11H2,1-7H3
InChIKeyYIVKEFJJAHHWHO-UHFFFAOYSA-N
XLogP3.81
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.47
LogP ≤ 53.81
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]oxymethyl]-2-ethylbutan-1-ol?
The IUPAC name of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethylbutan-1-ol (CID 19599358) is 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethylbutan-1-ol.
What is the SMILES notation for 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethylbutan-1-ol?
The canonical SMILES for 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethylbutan-1-ol is CCC(CC)(CO)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethylbutan-1-ol?
The InChIKey is YIVKEFJJAHHWHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30O2Si/c1-8-13(9-2,10-14)11-15-16(6,7)12(3,4)5/h14H,8-11H2,1-7H3.
What are the key properties of 2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethylbutan-1-ol?
2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2-ethylbutan-1-ol has a molecular weight of 246.47 g/mol, XLogP of 3.81, 6 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]oxymethyl]-2-ethylbutan-1-ol is sourced from PubChem (CID 19599358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).