1-fluorobutoxysilane

C4H11FOSi — CID 175244138

IUPAC1-fluorobutoxysilane
SMILESCCCC(F)O[SiH3]
InChIInChI=1S/C4H11FOSi/c1-2-3-4(5)6-7/h4H,2-3H2,1,7H3
InChIKeyGJIHXHJVGHTLGP-UHFFFAOYSA-N
MW122.21 g/mol
LogP0.38
Rot. Bonds3

About 1-fluorobutoxysilane

1-fluorobutoxysilane (PubChem CID 175244138) has the molecular formula C4H11FOSi and a molecular weight of 122.21 g/mol. Its IUPAC name is 1-fluorobutoxysilane.

Molecular Properties

Compound Name1-fluorobutoxysilane
PubChem CID175244138
Molecular FormulaC4H11FOSi
Molecular Weight122.21 g/mol
Exact Mass122.06
IUPAC Name1-fluorobutoxysilane
SMILESCCCC(F)O[SiH3]
InChIInChI=1S/C4H11FOSi/c1-2-3-4(5)6-7/h4H,2-3H2,1,7H3
InChIKeyGJIHXHJVGHTLGP-UHFFFAOYSA-N
XLogP0.38
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.21
LogP ≤ 50.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 1-fluorobutoxysilane?
The IUPAC name of 1-fluorobutoxysilane (CID 175244138) is 1-fluorobutoxysilane.
What is the SMILES notation for 1-fluorobutoxysilane?
The canonical SMILES for 1-fluorobutoxysilane is CCCC(F)O[SiH3].
What is the InChIKey of 1-fluorobutoxysilane?
The InChIKey is GJIHXHJVGHTLGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11FOSi/c1-2-3-4(5)6-7/h4H,2-3H2,1,7H3.
What are the key properties of 1-fluorobutoxysilane?
1-fluorobutoxysilane has a molecular weight of 122.21 g/mol, XLogP of 0.38, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluorobutoxysilane is sourced from PubChem (CID 175244138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).