4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol

C23H26O2Si — CID 159530954

IUPAC4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol
SMILESCc1cc(OC[SiH2]C(c2ccccc2)c2ccccc2)c(C)c(C)c1O
InChIInChI=1S/C23H26O2Si/c1-16-14-21(17(2)18(3)22(16)24)25-15-26-23(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-14,23-24H,15,26H2,1-3H3
InChIKeyMCZIWRXODIKMQK-UHFFFAOYSA-N
MW362.55 g/mol
LogP4.61
Rot. Bonds6

About 4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol

4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol (PubChem CID 159530954) has the molecular formula C23H26O2Si and a molecular weight of 362.55 g/mol. Its IUPAC name is 4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol.

Molecular Properties

Compound Name4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol
PubChem CID159530954
Molecular FormulaC23H26O2Si
Molecular Weight362.55 g/mol
Exact Mass362.17
IUPAC Name4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol
SMILESCc1cc(OC[SiH2]C(c2ccccc2)c2ccccc2)c(C)c(C)c1O
InChIInChI=1S/C23H26O2Si/c1-16-14-21(17(2)18(3)22(16)24)25-15-26-23(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-14,23-24H,15,26H2,1-3H3
InChIKeyMCZIWRXODIKMQK-UHFFFAOYSA-N
XLogP4.61
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.55
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol?
The IUPAC name of 4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol (CID 159530954) is 4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol.
What is the SMILES notation for 4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol?
The canonical SMILES for 4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol is Cc1cc(OC[SiH2]C(c2ccccc2)c2ccccc2)c(C)c(C)c1O.
What is the InChIKey of 4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol?
The InChIKey is MCZIWRXODIKMQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26O2Si/c1-16-14-21(17(2)18(3)22(16)24)25-15-26-23(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-14,23-24H,15,26H2,1-3H3.
What are the key properties of 4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol?
4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol has a molecular weight of 362.55 g/mol, XLogP of 4.61, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(benzhydrylsilylmethoxy)-2,3,6-trimethylphenol is sourced from PubChem (CID 159530954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).