1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol

C8H19FOSi — CID 10487572

IUPAC1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol
SMILESCC(C)C(O)CC[Si](C)(C)F
InChIInChI=1S/C8H19FOSi/c1-7(2)8(10)5-6-11(3,4)9/h7-8,10H,5-6H2,1-4H3
InChIKeyIEYMGPNGXXHHGL-UHFFFAOYSA-N
MW178.32 g/mol
LogP2.57
Rot. Bonds4

About 1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol

1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol (PubChem CID 10487572) has the molecular formula C8H19FOSi and a molecular weight of 178.32 g/mol. Its IUPAC name is 1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol.

Molecular Properties

Compound Name1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol
PubChem CID10487572
Molecular FormulaC8H19FOSi
Molecular Weight178.32 g/mol
Exact Mass178.12
IUPAC Name1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol
SMILESCC(C)C(O)CC[Si](C)(C)F
InChIInChI=1S/C8H19FOSi/c1-7(2)8(10)5-6-11(3,4)9/h7-8,10H,5-6H2,1-4H3
InChIKeyIEYMGPNGXXHHGL-UHFFFAOYSA-N
XLogP2.57
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.32
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol?
The IUPAC name of 1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol (CID 10487572) is 1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol.
What is the SMILES notation for 1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol?
The canonical SMILES for 1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol is CC(C)C(O)CC[Si](C)(C)F.
What is the InChIKey of 1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol?
The InChIKey is IEYMGPNGXXHHGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19FOSi/c1-7(2)8(10)5-6-11(3,4)9/h7-8,10H,5-6H2,1-4H3.
What are the key properties of 1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol?
1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol has a molecular weight of 178.32 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[fluoro(dimethyl)silyl]-4-methylpentan-3-ol is sourced from PubChem (CID 10487572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).