1-iodopropyl(propan-2-yloxy)silane

C6H15IOSi — CID 175551642

IUPAC1-iodopropyl(propan-2-yloxy)silane
SMILESCCC(I)[SiH2]OC(C)C
InChIInChI=1S/C6H15IOSi/c1-4-6(7)9-8-5(2)3/h5-6H,4,9H2,1-3H3
InChIKeyUELQCSHMAXRKMT-UHFFFAOYSA-N
MW258.17 g/mol
LogP1.67
Rot. Bonds4

About 1-iodopropyl(propan-2-yloxy)silane

1-iodopropyl(propan-2-yloxy)silane (PubChem CID 175551642) has the molecular formula C6H15IOSi and a molecular weight of 258.17 g/mol. Its IUPAC name is 1-iodopropyl(propan-2-yloxy)silane.

Molecular Properties

Compound Name1-iodopropyl(propan-2-yloxy)silane
PubChem CID175551642
Molecular FormulaC6H15IOSi
Molecular Weight258.17 g/mol
Exact Mass257.99
IUPAC Name1-iodopropyl(propan-2-yloxy)silane
SMILESCCC(I)[SiH2]OC(C)C
InChIInChI=1S/C6H15IOSi/c1-4-6(7)9-8-5(2)3/h5-6H,4,9H2,1-3H3
InChIKeyUELQCSHMAXRKMT-UHFFFAOYSA-N
XLogP1.67
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.17
LogP ≤ 51.67
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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Frequently Asked Questions

What is the IUPAC name of 1-iodopropyl(propan-2-yloxy)silane?
The IUPAC name of 1-iodopropyl(propan-2-yloxy)silane (CID 175551642) is 1-iodopropyl(propan-2-yloxy)silane.
What is the SMILES notation for 1-iodopropyl(propan-2-yloxy)silane?
The canonical SMILES for 1-iodopropyl(propan-2-yloxy)silane is CCC(I)[SiH2]OC(C)C.
What is the InChIKey of 1-iodopropyl(propan-2-yloxy)silane?
The InChIKey is UELQCSHMAXRKMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15IOSi/c1-4-6(7)9-8-5(2)3/h5-6H,4,9H2,1-3H3.
What are the key properties of 1-iodopropyl(propan-2-yloxy)silane?
1-iodopropyl(propan-2-yloxy)silane has a molecular weight of 258.17 g/mol, XLogP of 1.67, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-iodopropyl(propan-2-yloxy)silane is sourced from PubChem (CID 175551642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).