ethoxy-iodo-methyl-phenylsilane

C9H13IOSi — CID 154486985

IUPACethoxy-iodo-methyl-phenylsilane
SMILESCCO[Si](C)(I)c1ccccc1
InChIInChI=1S/C9H13IOSi/c1-3-11-12(2,10)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3
InChIKeyBSECDZYDFMWINW-UHFFFAOYSA-N
MW292.19 g/mol
LogP2.44
Rot. Bonds3

About ethoxy-iodo-methyl-phenylsilane

ethoxy-iodo-methyl-phenylsilane (PubChem CID 154486985) has the molecular formula C9H13IOSi and a molecular weight of 292.19 g/mol. Its IUPAC name is ethoxy-iodo-methyl-phenylsilane.

Molecular Properties

Compound Nameethoxy-iodo-methyl-phenylsilane
PubChem CID154486985
Molecular FormulaC9H13IOSi
Molecular Weight292.19 g/mol
Exact Mass291.98
IUPAC Nameethoxy-iodo-methyl-phenylsilane
SMILESCCO[Si](C)(I)c1ccccc1
InChIInChI=1S/C9H13IOSi/c1-3-11-12(2,10)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3
InChIKeyBSECDZYDFMWINW-UHFFFAOYSA-N
XLogP2.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.19
LogP ≤ 52.44
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'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

ethoxy-(ethoxy-methyl-phenylsilyl)-methyl-phenylsilane
CID 19809309
ethane;triethoxy(phenyl)silane
CID 174836592
silane;triethoxy(phenyl)silane;hydrofluoride
CID 174494492
[diethoxy(phenyl)silyl]oxy-diethoxy-phenylsilane
CID 14533277
diethoxy-phenyl-sulfanylsilane
CID 141237181
bis[[diethoxy(methyl)silyl]oxy]-methyl-phenylsilane
CID 141467412
fluorosilane;triethoxy(phenyl)silane
CID 174494490
ethoxy-ethyl-phenyl-propylsilane
CID 68659738
boric acid;triethoxy(phenyl)silane
CID 174800585
1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane
CID 54185163
ethoxy-methyl-phenyl-(2-triethylsilylethyl)silane
CID 59403722
(3,5-diiodophenyl)-diethoxy-phenylsilane
CID 153491530

Frequently Asked Questions

What is the IUPAC name of ethoxy-iodo-methyl-phenylsilane?
The IUPAC name of ethoxy-iodo-methyl-phenylsilane (CID 154486985) is ethoxy-iodo-methyl-phenylsilane.
What is the SMILES notation for ethoxy-iodo-methyl-phenylsilane?
The canonical SMILES for ethoxy-iodo-methyl-phenylsilane is CCO[Si](C)(I)c1ccccc1.
What is the InChIKey of ethoxy-iodo-methyl-phenylsilane?
The InChIKey is BSECDZYDFMWINW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13IOSi/c1-3-11-12(2,10)9-7-5-4-6-8-9/h4-8H,3H2,1-2H3.
What are the key properties of ethoxy-iodo-methyl-phenylsilane?
ethoxy-iodo-methyl-phenylsilane has a molecular weight of 292.19 g/mol, XLogP of 2.44, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-iodo-methyl-phenylsilane is sourced from PubChem (CID 154486985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).