1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane

C19H23FSi — CID 54737361

IUPAC1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane
SMILESCC[SiH]1CCC(c2cc(F)ccc2-c2ccccc2)CC1
InChIInChI=1S/C19H23FSi/c1-2-21-12-10-16(11-13-21)19-14-17(20)8-9-18(19)15-6-4-3-5-7-15/h3-9,14,16,21H,2,10-13H2,1H3
InChIKeyLHBGXYJADFUTQF-UHFFFAOYSA-N
MW298.48 g/mol
LogP5.62
Rot. Bonds3

About 1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane

1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane (PubChem CID 54737361) has the molecular formula C19H23FSi and a molecular weight of 298.48 g/mol. Its IUPAC name is 1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane.

Molecular Properties

Compound Name1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane
PubChem CID54737361
Molecular FormulaC19H23FSi
Molecular Weight298.48 g/mol
Exact Mass298.16
IUPAC Name1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane
SMILESCC[SiH]1CCC(c2cc(F)ccc2-c2ccccc2)CC1
InChIInChI=1S/C19H23FSi/c1-2-21-12-10-16(11-13-21)19-14-17(20)8-9-18(19)15-6-4-3-5-7-15/h3-9,14,16,21H,2,10-13H2,1H3
InChIKeyLHBGXYJADFUTQF-UHFFFAOYSA-N
XLogP5.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.48
LogP ≤ 55.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane?
The IUPAC name of 1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane (CID 54737361) is 1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane.
What is the SMILES notation for 1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane?
The canonical SMILES for 1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane is CC[SiH]1CCC(c2cc(F)ccc2-c2ccccc2)CC1.
What is the InChIKey of 1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane?
The InChIKey is LHBGXYJADFUTQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FSi/c1-2-21-12-10-16(11-13-21)19-14-17(20)8-9-18(19)15-6-4-3-5-7-15/h3-9,14,16,21H,2,10-13H2,1H3.
What are the key properties of 1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane?
1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane has a molecular weight of 298.48 g/mol, XLogP of 5.62, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(5-fluoro-2-phenylphenyl)silinane is sourced from PubChem (CID 54737361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).