tert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane

C23H32O3Si — CID 14524752

IUPACtert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane
SMILESCC1(C)OC[C@H](CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)O1
InChIInChI=1S/C23H32O3Si/c1-22(2,3)27(20-12-8-6-9-13-20,21-14-10-7-11-15-21)25-17-16-19-18-24-23(4,5)26-19/h6-15,19H,16-18H2,1-5H3/t19-/m0/s1
InChIKeyDTICEIYPTKVBKF-IBGZPJMESA-N
MW384.59 g/mol
LogP4.10
Rot. Bonds6

About tert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane

tert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane (PubChem CID 14524752) has the molecular formula C23H32O3Si and a molecular weight of 384.59 g/mol. Its IUPAC name is tert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane.

Molecular Properties

Compound Nametert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane
PubChem CID14524752
Molecular FormulaC23H32O3Si
Molecular Weight384.59 g/mol
Exact Mass384.21
IUPAC Nametert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane
SMILESCC1(C)OC[C@H](CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)O1
InChIInChI=1S/C23H32O3Si/c1-22(2,3)27(20-12-8-6-9-13-20,21-14-10-7-11-15-21)25-17-16-19-18-24-23(4,5)26-19/h6-15,19H,16-18H2,1-5H3/t19-/m0/s1
InChIKeyDTICEIYPTKVBKF-IBGZPJMESA-N
XLogP4.10
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.59
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze tert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane 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-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane?
The IUPAC name of tert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane (CID 14524752) is tert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane.
What is the SMILES notation for tert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane?
The canonical SMILES for tert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane is CC1(C)OC[C@H](CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)O1.
What is the InChIKey of tert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane?
The InChIKey is DTICEIYPTKVBKF-IBGZPJMESA-N. The full InChI is InChI=1S/C23H32O3Si/c1-22(2,3)27(20-12-8-6-9-13-20,21-14-10-7-11-15-21)25-17-16-19-18-24-23(4,5)26-19/h6-15,19H,16-18H2,1-5H3/t19-/m0/s1.
What are the key properties of tert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane?
tert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane has a molecular weight of 384.59 g/mol, XLogP of 4.10, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethoxy]-diphenylsilane is sourced from PubChem (CID 14524752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).