[4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane

C18H23FOSi — CID 90171756

IUPAC[4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane
SMILESCC(C)[Si](O)(c1ccc(-c2ccc(F)cc2)cc1)C(C)C
InChIInChI=1S/C18H23FOSi/c1-13(2)21(20,14(3)4)18-11-7-16(8-12-18)15-5-9-17(19)10-6-15/h5-14,20H,1-4H3
InChIKeyRXRQKHSURAAFNX-UHFFFAOYSA-N
MW302.47 g/mol
LogP4.46
Rot. Bonds4

About [4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane

[4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane (PubChem CID 90171756) has the molecular formula C18H23FOSi and a molecular weight of 302.47 g/mol. Its IUPAC name is [4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane.

Molecular Properties

Compound Name[4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane
PubChem CID90171756
Molecular FormulaC18H23FOSi
Molecular Weight302.47 g/mol
Exact Mass302.15
IUPAC Name[4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane
SMILESCC(C)[Si](O)(c1ccc(-c2ccc(F)cc2)cc1)C(C)C
InChIInChI=1S/C18H23FOSi/c1-13(2)21(20,14(3)4)18-11-7-16(8-12-18)15-5-9-17(19)10-6-15/h5-14,20H,1-4H3
InChIKeyRXRQKHSURAAFNX-UHFFFAOYSA-N
XLogP4.46
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.47
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 [4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane?
The IUPAC name of [4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane (CID 90171756) is [4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane.
What is the SMILES notation for [4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane?
The canonical SMILES for [4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane is CC(C)[Si](O)(c1ccc(-c2ccc(F)cc2)cc1)C(C)C.
What is the InChIKey of [4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane?
The InChIKey is RXRQKHSURAAFNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23FOSi/c1-13(2)21(20,14(3)4)18-11-7-16(8-12-18)15-5-9-17(19)10-6-15/h5-14,20H,1-4H3.
What are the key properties of [4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane?
[4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane has a molecular weight of 302.47 g/mol, XLogP of 4.46, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-fluorophenyl)phenyl]-hydroxy-di(propan-2-yl)silane is sourced from PubChem (CID 90171756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).