CID 136711057

C11H18FO2Si2 — CID 136711057

IUPAC—
SMILESC[Si](C)O[Si](C)(C)OCc1ccc(F)cc1
InChIInChI=1S/C11H18FO2Si2/c1-15(2)14-16(3,4)13-9-10-5-7-11(12)8-6-10/h5-8H,9H2,1-4H3
InChIKeyIOOZZYOLAZXCEU-UHFFFAOYSA-N
MW257.43 g/mol
LogP3.31
Rot. Bonds5

About CID 136711057

CID 136711057 (PubChem CID 136711057) has the molecular formula C11H18FO2Si2 and a molecular weight of 257.43 g/mol.

Molecular Properties

Compound NameCID 136711057
PubChem CID136711057
Molecular FormulaC11H18FO2Si2
Molecular Weight257.43 g/mol
Exact Mass257.08
IUPAC Name—
SMILESC[Si](C)O[Si](C)(C)OCc1ccc(F)cc1
InChIInChI=1S/C11H18FO2Si2/c1-15(2)14-16(3,4)13-9-10-5-7-11(12)8-6-10/h5-8H,9H2,1-4H3
InChIKeyIOOZZYOLAZXCEU-UHFFFAOYSA-N
XLogP3.31
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.43
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 CID 136711057?
The IUPAC name of CID 136711057 (CID 136711057) is not available.
What is the SMILES notation for CID 136711057?
The canonical SMILES for CID 136711057 is C[Si](C)O[Si](C)(C)OCc1ccc(F)cc1.
What is the InChIKey of CID 136711057?
The InChIKey is IOOZZYOLAZXCEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18FO2Si2/c1-15(2)14-16(3,4)13-9-10-5-7-11(12)8-6-10/h5-8H,9H2,1-4H3.
What are the key properties of CID 136711057?
CID 136711057 has a molecular weight of 257.43 g/mol, XLogP of 3.31, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 136711057 is sourced from PubChem (CID 136711057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).