4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane

C18H21FOSi — CID 123941508

IUPAC4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane
SMILESCO[SiH]1CCC(c2ccc(-c3ccc(F)cc3)cc2)CC1
InChIInChI=1S/C18H21FOSi/c1-20-21-12-10-17(11-13-21)15-4-2-14(3-5-15)16-6-8-18(19)9-7-16/h2-9,17,21H,10-13H2,1H3
InChIKeyNVBBZSOXECFGTD-UHFFFAOYSA-N
MW300.45 g/mol
LogP4.74
Rot. Bonds3

About 4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane

4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane (PubChem CID 123941508) has the molecular formula C18H21FOSi and a molecular weight of 300.45 g/mol. Its IUPAC name is 4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane.

Molecular Properties

Compound Name4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane
PubChem CID123941508
Molecular FormulaC18H21FOSi
Molecular Weight300.45 g/mol
Exact Mass300.13
IUPAC Name4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane
SMILESCO[SiH]1CCC(c2ccc(-c3ccc(F)cc3)cc2)CC1
InChIInChI=1S/C18H21FOSi/c1-20-21-12-10-17(11-13-21)15-4-2-14(3-5-15)16-6-8-18(19)9-7-16/h2-9,17,21H,10-13H2,1H3
InChIKeyNVBBZSOXECFGTD-UHFFFAOYSA-N
XLogP4.74
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.45
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-[2-[4-(4-fluorophenyl)phenyl]ethyl]-1-methoxysilinane
CID 123190517
1-fluoro-4-[4-(4-fluorophenyl)cyclohexyl]benzene
CID 122631633
2-[4-(4-cyclopropylphenyl)phenyl]-6-[4-(4-fluorophenyl)phenyl]naphthalene
CID 170293668
1,1-dichloro-4-[4-(4-fluorophenyl)phenyl]silinane
CID 22404089
1-fluoro-4-[4-(4-propylcyclohexyl)phenyl]benzene
CID 611152
nonacyclo[28.2.2.22,5.26,9.210,13.214,17.218,21.222,25.226,29]octatetraconta-1(32),6(46),7,9(45),10(44),11,13(43),14(42),15,17(41),22,24,26,28,30,33,35,37-octadecaene
CID 135033819
ethane;4-(4-fluorophenyl)piperidine
CID 144692128
4-(4-fluorophenyl)-1-heptylsilinane
CID 54037116
1-fluoro-4-(4-fluorocyclohexyl)benzene
CID 23539867
1-fluoro-4-(4-methylcyclohexyl)benzene;molecular hydrogen
CID 158127728
1-methyl-4-[4-[4-(4-methylphenyl)cyclohexyl]phenyl]benzene
CID 59265320
4-[4-(3,4-difluorophenyl)phenyl]-1-ethylsilinane
CID 54735927

Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane?
The IUPAC name of 4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane (CID 123941508) is 4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane.
What is the SMILES notation for 4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane?
The canonical SMILES for 4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane is CO[SiH]1CCC(c2ccc(-c3ccc(F)cc3)cc2)CC1.
What is the InChIKey of 4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane?
The InChIKey is NVBBZSOXECFGTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FOSi/c1-20-21-12-10-17(11-13-21)15-4-2-14(3-5-15)16-6-8-18(19)9-7-16/h2-9,17,21H,10-13H2,1H3.
What are the key properties of 4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane?
4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane has a molecular weight of 300.45 g/mol, XLogP of 4.74, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-fluorophenyl)phenyl]-1-methoxysilinane is sourced from PubChem (CID 123941508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).