4-[4-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol

C24H28OSi — CID 153277090

IUPAC4-[4-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol
SMILESCCCC[Si](C)(C)c1ccc(-c2ccc(-c3ccc(O)cc3)cc2)cc1
InChIInChI=1S/C24H28OSi/c1-4-5-18-26(2,3)24-16-12-22(13-17-24)20-8-6-19(7-9-20)21-10-14-23(25)15-11-21/h6-17,25H,4-5,18H2,1-3H3
InChIKeyBKPXFRWEWXGLCN-UHFFFAOYSA-N
MW360.57 g/mol
LogP6.44
Rot. Bonds6

About 4-[4-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol

4-[4-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol (PubChem CID 153277090) has the molecular formula C24H28OSi and a molecular weight of 360.57 g/mol. Its IUPAC name is 4-[4-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol.

Molecular Properties

Compound Name4-[4-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol
PubChem CID153277090
Molecular FormulaC24H28OSi
Molecular Weight360.57 g/mol
Exact Mass360.19
IUPAC Name4-[4-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol
SMILESCCCC[Si](C)(C)c1ccc(-c2ccc(-c3ccc(O)cc3)cc2)cc1
InChIInChI=1S/C24H28OSi/c1-4-5-18-26(2,3)24-16-12-22(13-17-24)20-8-6-19(7-9-20)21-10-14-23(25)15-11-21/h6-17,25H,4-5,18H2,1-3H3
InChIKeyBKPXFRWEWXGLCN-UHFFFAOYSA-N
XLogP6.44
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.57
LogP ≤ 56.44
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-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol?
The IUPAC name of 4-[4-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol (CID 153277090) is 4-[4-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol.
What is the SMILES notation for 4-[4-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol?
The canonical SMILES for 4-[4-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol is CCCC[Si](C)(C)c1ccc(-c2ccc(-c3ccc(O)cc3)cc2)cc1.
What is the InChIKey of 4-[4-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol?
The InChIKey is BKPXFRWEWXGLCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28OSi/c1-4-5-18-26(2,3)24-16-12-22(13-17-24)20-8-6-19(7-9-20)21-10-14-23(25)15-11-21/h6-17,25H,4-5,18H2,1-3H3.
What are the key properties of 4-[4-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol?
4-[4-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol has a molecular weight of 360.57 g/mol, XLogP of 6.44, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[4-[butyl(dimethyl)silyl]phenyl]phenyl]phenol is sourced from PubChem (CID 153277090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).