tert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane

C24H38O2Si2 — CID 126970723

IUPACtert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(-c2ccc(O[Si](C)(C)C(C)(C)C)cc2)cc1
InChIInChI=1S/C24H38O2Si2/c1-23(2,3)27(7,8)25-21-15-11-19(12-16-21)20-13-17-22(18-14-20)26-28(9,10)24(4,5)6/h11-18H,1-10H3
InChIKeyLDADQDWXKQGXMR-UHFFFAOYSA-N
MW414.74 g/mol
LogP8.12
Rot. Bonds5

About tert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane

tert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane (PubChem CID 126970723) has the molecular formula C24H38O2Si2 and a molecular weight of 414.74 g/mol. Its IUPAC name is tert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane
PubChem CID126970723
Molecular FormulaC24H38O2Si2
Molecular Weight414.74 g/mol
Exact Mass414.24
IUPAC Nametert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)Oc1ccc(-c2ccc(O[Si](C)(C)C(C)(C)C)cc2)cc1
InChIInChI=1S/C24H38O2Si2/c1-23(2,3)27(7,8)25-21-15-11-19(12-16-21)20-13-17-22(18-14-20)26-28(9,10)24(4,5)6/h11-18H,1-10H3
InChIKeyLDADQDWXKQGXMR-UHFFFAOYSA-N
XLogP8.12
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.74
LogP ≤ 58.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze tert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane 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 tert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane (CID 126970723) is tert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane is CC(C)(C)[Si](C)(C)Oc1ccc(-c2ccc(O[Si](C)(C)C(C)(C)C)cc2)cc1.
What is the InChIKey of tert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane?
The InChIKey is LDADQDWXKQGXMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H38O2Si2/c1-23(2,3)27(7,8)25-21-15-11-19(12-16-21)20-13-17-22(18-14-20)26-28(9,10)24(4,5)6/h11-18H,1-10H3.
What are the key properties of tert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane?
tert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane has a molecular weight of 414.74 g/mol, XLogP of 8.12, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[4-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]phenoxy]-dimethylsilane is sourced from PubChem (CID 126970723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).