5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol

C10H19FO2Si — CID 59660061

IUPAC5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol
SMILESC#CC(C)(O)CCO[Si](C)(C)CCF
InChIInChI=1S/C10H19FO2Si/c1-5-10(2,12)6-8-13-14(3,4)9-7-11/h1,12H,6-9H2,2-4H3
InChIKeyZQOIIEUGXZITHM-UHFFFAOYSA-N
MW218.34 g/mol
LogP1.95
Rot. Bonds6

About 5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol

5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol (PubChem CID 59660061) has the molecular formula C10H19FO2Si and a molecular weight of 218.34 g/mol. Its IUPAC name is 5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol.

Molecular Properties

Compound Name5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol
PubChem CID59660061
Molecular FormulaC10H19FO2Si
Molecular Weight218.34 g/mol
Exact Mass218.11
IUPAC Name5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol
SMILESC#CC(C)(O)CCO[Si](C)(C)CCF
InChIInChI=1S/C10H19FO2Si/c1-5-10(2,12)6-8-13-14(3,4)9-7-11/h1,12H,6-9H2,2-4H3
InChIKeyZQOIIEUGXZITHM-UHFFFAOYSA-N
XLogP1.95
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol?
The IUPAC name of 5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol (CID 59660061) is 5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol.
What is the SMILES notation for 5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol?
The canonical SMILES for 5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol is C#CC(C)(O)CCO[Si](C)(C)CCF.
What is the InChIKey of 5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol?
The InChIKey is ZQOIIEUGXZITHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FO2Si/c1-5-10(2,12)6-8-13-14(3,4)9-7-11/h1,12H,6-9H2,2-4H3.
What are the key properties of 5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol?
5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol has a molecular weight of 218.34 g/mol, XLogP of 1.95, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-fluoroethyl(dimethyl)silyl]oxy-3-methylpent-1-yn-3-ol is sourced from PubChem (CID 59660061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).