ethyl-(9-fluorononoxy)-methoxy-methylsilane

C13H29FO2Si — CID 87402580

IUPACethyl-(9-fluorononoxy)-methoxy-methylsilane
SMILESCC[Si](C)(OC)OCCCCCCCCCF
InChIInChI=1S/C13H29FO2Si/c1-4-17(3,15-2)16-13-11-9-7-5-6-8-10-12-14/h4-13H2,1-3H3
InChIKeyWQRXDQYCQGWGQR-UHFFFAOYSA-N
MW264.46 g/mol
LogP4.44
Rot. Bonds12

About ethyl-(9-fluorononoxy)-methoxy-methylsilane

ethyl-(9-fluorononoxy)-methoxy-methylsilane (PubChem CID 87402580) has the molecular formula C13H29FO2Si and a molecular weight of 264.46 g/mol. Its IUPAC name is ethyl-(9-fluorononoxy)-methoxy-methylsilane.

Molecular Properties

Compound Nameethyl-(9-fluorononoxy)-methoxy-methylsilane
PubChem CID87402580
Molecular FormulaC13H29FO2Si
Molecular Weight264.46 g/mol
Exact Mass264.19
IUPAC Nameethyl-(9-fluorononoxy)-methoxy-methylsilane
SMILESCC[Si](C)(OC)OCCCCCCCCCF
InChIInChI=1S/C13H29FO2Si/c1-4-17(3,15-2)16-13-11-9-7-5-6-8-10-12-14/h4-13H2,1-3H3
InChIKeyWQRXDQYCQGWGQR-UHFFFAOYSA-N
XLogP4.44
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.46
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethyl-(9-fluorononoxy)-methoxy-methylsilane?
The IUPAC name of ethyl-(9-fluorononoxy)-methoxy-methylsilane (CID 87402580) is ethyl-(9-fluorononoxy)-methoxy-methylsilane.
What is the SMILES notation for ethyl-(9-fluorononoxy)-methoxy-methylsilane?
The canonical SMILES for ethyl-(9-fluorononoxy)-methoxy-methylsilane is CC[Si](C)(OC)OCCCCCCCCCF.
What is the InChIKey of ethyl-(9-fluorononoxy)-methoxy-methylsilane?
The InChIKey is WQRXDQYCQGWGQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29FO2Si/c1-4-17(3,15-2)16-13-11-9-7-5-6-8-10-12-14/h4-13H2,1-3H3.
What are the key properties of ethyl-(9-fluorononoxy)-methoxy-methylsilane?
ethyl-(9-fluorononoxy)-methoxy-methylsilane has a molecular weight of 264.46 g/mol, XLogP of 4.44, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-(9-fluorononoxy)-methoxy-methylsilane is sourced from PubChem (CID 87402580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).