triethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane

C17H31FO2Si — CID 76625377

IUPACtriethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane
SMILESC=CCOC1CCCC(O[Si](CC)(CC)CC)=C(F)CC1
InChIInChI=1S/C17H31FO2Si/c1-5-14-19-15-10-9-11-17(16(18)13-12-15)20-21(6-2,7-3)8-4/h5,15H,1,6-14H2,2-4H3
InChIKeyGZUQARICWPCFHY-UHFFFAOYSA-N
MW314.52 g/mol
LogP5.72
Rot. Bonds8

About triethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane

triethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane (PubChem CID 76625377) has the molecular formula C17H31FO2Si and a molecular weight of 314.52 g/mol. Its IUPAC name is triethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane.

Molecular Properties

Compound Nametriethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane
PubChem CID76625377
Molecular FormulaC17H31FO2Si
Molecular Weight314.52 g/mol
Exact Mass314.21
IUPAC Nametriethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane
SMILESC=CCOC1CCCC(O[Si](CC)(CC)CC)=C(F)CC1
InChIInChI=1S/C17H31FO2Si/c1-5-14-19-15-10-9-11-17(16(18)13-12-15)20-21(6-2,7-3)8-4/h5,15H,1,6-14H2,2-4H3
InChIKeyGZUQARICWPCFHY-UHFFFAOYSA-N
XLogP5.72
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.52
LogP ≤ 55.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane?
The IUPAC name of triethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane (CID 76625377) is triethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane.
What is the SMILES notation for triethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane?
The canonical SMILES for triethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane is C=CCOC1CCCC(O[Si](CC)(CC)CC)=C(F)CC1.
What is the InChIKey of triethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane?
The InChIKey is GZUQARICWPCFHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31FO2Si/c1-5-14-19-15-10-9-11-17(16(18)13-12-15)20-21(6-2,7-3)8-4/h5,15H,1,6-14H2,2-4H3.
What are the key properties of triethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane?
triethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane has a molecular weight of 314.52 g/mol, XLogP of 5.72, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane is sourced from PubChem (CID 76625377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).