CID 175605209

C6H6FO2Si — CID 175605209

IUPAC—
SMILESF[Si].Oc1ccccc1O
InChIInChI=1S/C6H6O2.FSi/c7-5-3-1-2-4-6(5)8;1-2/h1-4,7-8H;
InChIKeyWDHNMKDAWJIXSM-UHFFFAOYSA-N
MW157.20 g/mol
LogP1.14
Rot. Bonds

About CID 175605209

CID 175605209 (PubChem CID 175605209) has the molecular formula C6H6FO2Si and a molecular weight of 157.20 g/mol.

Molecular Properties

Compound NameCID 175605209
PubChem CID175605209
Molecular FormulaC6H6FO2Si
Molecular Weight157.20 g/mol
Exact Mass157.01
IUPAC Name—
SMILESF[Si].Oc1ccccc1O
InChIInChI=1S/C6H6O2.FSi/c7-5-3-1-2-4-6(5)8;1-2/h1-4,7-8H;
InChIKeyWDHNMKDAWJIXSM-UHFFFAOYSA-N
XLogP1.14
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.20
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol_A(92)', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

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CID 6393025
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Frequently Asked Questions

What is the IUPAC name of CID 175605209?
The IUPAC name of CID 175605209 (CID 175605209) is not available.
What is the SMILES notation for CID 175605209?
The canonical SMILES for CID 175605209 is F[Si].Oc1ccccc1O.
What is the InChIKey of CID 175605209?
The InChIKey is WDHNMKDAWJIXSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6O2.FSi/c7-5-3-1-2-4-6(5)8;1-2/h1-4,7-8H;.
What are the key properties of CID 175605209?
CID 175605209 has a molecular weight of 157.20 g/mol, XLogP of 1.14, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175605209 is sourced from PubChem (CID 175605209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).