iodo(tripropoxy)silane

C9H21IO3Si — CID 18669781

IUPACiodo(tripropoxy)silane
SMILESCCCO[Si](I)(OCCC)OCCC
InChIInChI=1S/C9H21IO3Si/c1-4-7-11-14(10,12-8-5-2)13-9-6-3/h4-9H2,1-3H3
InChIKeyMRTOEZXKZWQASA-UHFFFAOYSA-N
MW332.25 g/mol
LogP3.14
Rot. Bonds9

About iodo(tripropoxy)silane

iodo(tripropoxy)silane (PubChem CID 18669781) has the molecular formula C9H21IO3Si and a molecular weight of 332.25 g/mol. Its IUPAC name is iodo(tripropoxy)silane.

Molecular Properties

Compound Nameiodo(tripropoxy)silane
PubChem CID18669781
Molecular FormulaC9H21IO3Si
Molecular Weight332.25 g/mol
Exact Mass332.03
IUPAC Nameiodo(tripropoxy)silane
SMILESCCCO[Si](I)(OCCC)OCCC
InChIInChI=1S/C9H21IO3Si/c1-4-7-11-14(10,12-8-5-2)13-9-6-3/h4-9H2,1-3H3
InChIKeyMRTOEZXKZWQASA-UHFFFAOYSA-N
XLogP3.14
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.25
LogP ≤ 53.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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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Frequently Asked Questions

What is the IUPAC name of iodo(tripropoxy)silane?
The IUPAC name of iodo(tripropoxy)silane (CID 18669781) is iodo(tripropoxy)silane.
What is the SMILES notation for iodo(tripropoxy)silane?
The canonical SMILES for iodo(tripropoxy)silane is CCCO[Si](I)(OCCC)OCCC.
What is the InChIKey of iodo(tripropoxy)silane?
The InChIKey is MRTOEZXKZWQASA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21IO3Si/c1-4-7-11-14(10,12-8-5-2)13-9-6-3/h4-9H2,1-3H3.
What are the key properties of iodo(tripropoxy)silane?
iodo(tripropoxy)silane has a molecular weight of 332.25 g/mol, XLogP of 3.14, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for iodo(tripropoxy)silane is sourced from PubChem (CID 18669781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).