tert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane

C13H21IOSi — CID 10020633

IUPACtert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCc1ccc(I)cc1
InChIInChI=1S/C13H21IOSi/c1-13(2,3)16(4,5)15-10-11-6-8-12(14)9-7-11/h6-9H,10H2,1-5H3
InChIKeyHJACHJOGIDAXCP-UHFFFAOYSA-N
MW348.30 g/mol
LogP4.81
Rot. Bonds3

About tert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane

tert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane (PubChem CID 10020633) has the molecular formula C13H21IOSi and a molecular weight of 348.30 g/mol. Its IUPAC name is tert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane
PubChem CID10020633
Molecular FormulaC13H21IOSi
Molecular Weight348.30 g/mol
Exact Mass348.04
IUPAC Nametert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCc1ccc(I)cc1
InChIInChI=1S/C13H21IOSi/c1-13(2,3)16(4,5)15-10-11-6-8-12(14)9-7-11/h6-9H,10H2,1-5H3
InChIKeyHJACHJOGIDAXCP-UHFFFAOYSA-N
XLogP4.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.30
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-dimethyl-[(4-methylphenyl)methoxy]silane
CID 21304531
tert-butyl-[(4-tert-butylphenyl)methoxy]-dimethylsilane
CID 101140446
(4-bromophenyl)methoxy-tert-butyl-dimethylsilane
CID 10859583
[4-(bromomethyl)phenyl]methoxy-tert-butyl-dimethylsilane
CID 10757711
tert-butyl-[(3-iodophenyl)methoxy]-dimethylsilane
CID 66845200
tert-butyl-[[4-[4-[[4-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methoxy]but-2-enoxymethyl]phenyl]methoxy]-dimethylsilane
CID 68636763
tert-butyl-[[4-(4-chlorobutyl)phenyl]methoxy]-dimethylsilane
CID 24796696
2-[[4-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methoxy]isoindole-1,3-dione
CID 101060892
tert-butyl-[[4-[2-[4-[2-[[4-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methoxy]ethoxy]but-2-enoxy]ethoxymethyl]phenyl]methoxy]-dimethylsilane
CID 76826455
tert-butyl-[[4-[2-[(E)-4-[2-[[4-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]methoxy]ethoxy]but-2-enoxy]ethoxymethyl]phenyl]methoxy]-dimethylsilane
CID 58596731
tert-butyl-dimethyl-[[4-[3-(trifluoromethyl)diazirin-3-yl]phenyl]methoxy]silane
CID 13063205
tert-butyl-dimethyl-[(4-pyridazin-4-ylphenyl)methoxy]silane
CID 18182550

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane (CID 10020633) is tert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane is CC(C)(C)[Si](C)(C)OCc1ccc(I)cc1.
What is the InChIKey of tert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane?
The InChIKey is HJACHJOGIDAXCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21IOSi/c1-13(2,3)16(4,5)15-10-11-6-8-12(14)9-7-11/h6-9H,10H2,1-5H3.
What are the key properties of tert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane?
tert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane has a molecular weight of 348.30 g/mol, XLogP of 4.81, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(4-iodophenyl)methoxy]-dimethylsilane is sourced from PubChem (CID 10020633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).