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

C17H32O2Si — CID 76625366

IUPACtriethyl-(5-prop-2-enoxycycloocten-1-yl)oxysilane
SMILESC=CCOC1CCC=C(O[Si](CC)(CC)CC)CCC1
InChIInChI=1S/C17H32O2Si/c1-5-15-18-16-11-9-13-17(14-10-12-16)19-20(6-2,7-3)8-4/h5,13,16H,1,6-12,14-15H2,2-4H3
InChIKeyXWGHSAAXQUXNFL-UHFFFAOYSA-N
MW296.53 g/mol
LogP5.43
Rot. Bonds8

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

triethyl-(5-prop-2-enoxycycloocten-1-yl)oxysilane (PubChem CID 76625366) has the molecular formula C17H32O2Si and a molecular weight of 296.53 g/mol. Its IUPAC name is triethyl-(5-prop-2-enoxycycloocten-1-yl)oxysilane.

Molecular Properties

Compound Nametriethyl-(5-prop-2-enoxycycloocten-1-yl)oxysilane
PubChem CID76625366
Molecular FormulaC17H32O2Si
Molecular Weight296.53 g/mol
Exact Mass296.22
IUPAC Nametriethyl-(5-prop-2-enoxycycloocten-1-yl)oxysilane
SMILESC=CCOC1CCC=C(O[Si](CC)(CC)CC)CCC1
InChIInChI=1S/C17H32O2Si/c1-5-15-18-16-11-9-13-17(14-10-12-16)19-20(6-2,7-3)8-4/h5,13,16H,1,6-12,14-15H2,2-4H3
InChIKeyXWGHSAAXQUXNFL-UHFFFAOYSA-N
XLogP5.43
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.53
LogP ≤ 55.43
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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Related Compounds

triethyl-[(1Z)-2-fluoro-5-prop-2-enoxycycloocten-1-yl]oxysilane
CID 57611683
Triethyl-(2-fluoro-5-prop-2-enoxycycloocten-1-yl)oxysilane
CID 76625377
triethyl-[(1E)-5-prop-2-enoxycycloocten-1-yl]oxysilane
CID 57611648
CID 24865503
CID 24865503
tert-butyl-dimethyl-[(1S)-1-[(2S)-5-[(E)-prop-1-enyl]oxolan-2-yl]pentoxy]silane
CID 102021073

Frequently Asked Questions

What is the IUPAC name of triethyl-(5-prop-2-enoxycycloocten-1-yl)oxysilane?
The IUPAC name of triethyl-(5-prop-2-enoxycycloocten-1-yl)oxysilane (CID 76625366) is triethyl-(5-prop-2-enoxycycloocten-1-yl)oxysilane.
What is the SMILES notation for triethyl-(5-prop-2-enoxycycloocten-1-yl)oxysilane?
The canonical SMILES for triethyl-(5-prop-2-enoxycycloocten-1-yl)oxysilane is C=CCOC1CCC=C(O[Si](CC)(CC)CC)CCC1.
What is the InChIKey of triethyl-(5-prop-2-enoxycycloocten-1-yl)oxysilane?
The InChIKey is XWGHSAAXQUXNFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32O2Si/c1-5-15-18-16-11-9-13-17(14-10-12-16)19-20(6-2,7-3)8-4/h5,13,16H,1,6-12,14-15H2,2-4H3.
What are the key properties of triethyl-(5-prop-2-enoxycycloocten-1-yl)oxysilane?
triethyl-(5-prop-2-enoxycycloocten-1-yl)oxysilane has a molecular weight of 296.53 g/mol, XLogP of 5.43, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-(5-prop-2-enoxycycloocten-1-yl)oxysilane is sourced from PubChem (CID 76625366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).