Tert-butyl(2-iodoethoxy)diphenylsilane

C18H23IOSi — CID 11269862

IUPACtert-butyl-(2-iodoethoxy)-diphenylsilane
SMILESCC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OCCI
InChIInChI=1S/C18H23IOSi/c1-18(2,3)21(20-15-14-19,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,14-15H2,1-3H3
InChIKeyXRGRXPFJGNTEAB-UHFFFAOYSA-N
MW410.40 g/mol
LogP—
Rot. Bonds6

About Tert-butyl(2-iodoethoxy)diphenylsilane

Tert-butyl(2-iodoethoxy)diphenylsilane (PubChem CID 11269862) has the molecular formula C18H23IOSi and a molecular weight of 410.40 g/mol. Its IUPAC name is tert-butyl-(2-iodoethoxy)-diphenylsilane.

Molecular Properties

Compound NameTert-butyl(2-iodoethoxy)diphenylsilane
PubChem CID11269862
Molecular FormulaC18H23IOSi
Molecular Weight410.40 g/mol
Exact Mass410.06
IUPAC Nametert-butyl-(2-iodoethoxy)-diphenylsilane
SMILESCC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OCCI
InChIInChI=1S/C18H23IOSi/c1-18(2,3)21(20-15-14-19,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,14-15H2,1-3H3
InChIKeyXRGRXPFJGNTEAB-UHFFFAOYSA-N
XLogP—
TPSA9.20 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms21
Complexity283

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Diphenyldimethoxysilane
CID 81284
1,3-Diphenyltetramethyldisiloxane
CID 5945
Ethoxydimethylphenylsilane
CID 15770
Diphenyldiethoxysilane
CID 75705
Benzene, (diethoxymethylsilyl)-
CID 69891
Benzene, 1,1',1''-(ethoxysilylidyne)tris-
CID 73695
Ethoxymethyldiphenylsilane
CID 74576
Methoxytriphenylsilane
CID 74588
Silane, (1,1-dimethylethyl)diphenyl(2-propynyloxy)-
CID 610226
Diphenylvinylethoxysilane
CID 87366
tert-Butoxy(chloro)diphenylsilane
CID 2735650
(2-Bromoethoxy)(tert-butyl)diphenylsilane
CID 10915442

Frequently Asked Questions

What is the IUPAC name of Tert-butyl(2-iodoethoxy)diphenylsilane?
The IUPAC name of Tert-butyl(2-iodoethoxy)diphenylsilane (CID 11269862) is tert-butyl-(2-iodoethoxy)-diphenylsilane.
What is the SMILES notation for Tert-butyl(2-iodoethoxy)diphenylsilane?
The canonical SMILES for Tert-butyl(2-iodoethoxy)diphenylsilane is CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OCCI.
What is the InChIKey of Tert-butyl(2-iodoethoxy)diphenylsilane?
The InChIKey is XRGRXPFJGNTEAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23IOSi/c1-18(2,3)21(20-15-14-19,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,14-15H2,1-3H3.
What are the key properties of Tert-butyl(2-iodoethoxy)diphenylsilane?
Tert-butyl(2-iodoethoxy)diphenylsilane has a molecular weight of 410.40 g/mol, XLogP of not available, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for Tert-butyl(2-iodoethoxy)diphenylsilane is sourced from PubChem (CID 11269862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).