4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol

C21H30O2Si — CID 54288715

IUPAC4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol
SMILESCC(C)(Cc1ccc(O)cc1)[Si](C)(C)CCCc1ccc(O)cc1
InChIInChI=1S/C21H30O2Si/c1-21(2,16-18-9-13-20(23)14-10-18)24(3,4)15-5-6-17-7-11-19(22)12-8-17/h7-14,22-23H,5-6,15-16H2,1-4H3
InChIKeyCWBPKDUPABXOJW-UHFFFAOYSA-N
MW342.56 g/mol
LogP5.76
Rot. Bonds7

About 4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol

4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol (PubChem CID 54288715) has the molecular formula C21H30O2Si and a molecular weight of 342.56 g/mol. Its IUPAC name is 4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol.

Molecular Properties

Compound Name4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol
PubChem CID54288715
Molecular FormulaC21H30O2Si
Molecular Weight342.56 g/mol
Exact Mass342.20
IUPAC Name4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol
SMILESCC(C)(Cc1ccc(O)cc1)[Si](C)(C)CCCc1ccc(O)cc1
InChIInChI=1S/C21H30O2Si/c1-21(2,16-18-9-13-20(23)14-10-18)24(3,4)15-5-6-17-7-11-19(22)12-8-17/h7-14,22-23H,5-6,15-16H2,1-4H3
InChIKeyCWBPKDUPABXOJW-UHFFFAOYSA-N
XLogP5.76
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.56
LogP ≤ 55.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[3-[[[[[3-(4-hydroxyphenyl)propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propyl]phenol
CID 23368907
4-[3-[4-(3,3-dimethylbutyl)phenyl]propyl]phenol
CID 58897702
4-(4,4-dimethylpentyl)phenol
CID 20692467
4-[3-[hydroxy(dimethyl)silyl]-3-methylbutyl]phenol
CID 71156678
ethane;4-[3-[4-[4-[3-(4-hydroxyphenyl)propyl]phenyl]phenyl]propyl]phenol
CID 91387150
4-[11-(4-hydroxyphenyl)undecyl]phenol
CID 23191182
4-[4-(6-trimethylsilylhexyl)phenyl]phenol
CID 19763846
1-(4-hydroxyphenyl)propane-2,2-diol
CID 71429856
4-[2-(4-heptylphenyl)-2-methylpropyl]phenol
CID 67225424
4-[3-[(2-methylpropan-2-yl)oxy]propyl]phenol
CID 86258794
4-butylphenol;tungsten
CID 174758928
4-[3-[4-(4-propylphenyl)phenyl]propyl]phenol
CID 59265255

Frequently Asked Questions

What is the IUPAC name of 4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol?
The IUPAC name of 4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol (CID 54288715) is 4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol.
What is the SMILES notation for 4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol?
The canonical SMILES for 4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol is CC(C)(Cc1ccc(O)cc1)[Si](C)(C)CCCc1ccc(O)cc1.
What is the InChIKey of 4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol?
The InChIKey is CWBPKDUPABXOJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30O2Si/c1-21(2,16-18-9-13-20(23)14-10-18)24(3,4)15-5-6-17-7-11-19(22)12-8-17/h7-14,22-23H,5-6,15-16H2,1-4H3.
What are the key properties of 4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol?
4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol has a molecular weight of 342.56 g/mol, XLogP of 5.76, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[[1-(4-hydroxyphenyl)-2-methylpropan-2-yl]-dimethylsilyl]propyl]phenol is sourced from PubChem (CID 54288715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).