1-hexoxypropylsilane

C9H22OSi — CID 174351834

IUPAC1-hexoxypropylsilane
SMILESCCCCCCOC([SiH3])CC
InChIInChI=1S/C9H22OSi/c1-3-5-6-7-8-10-9(11)4-2/h9H,3-8H2,1-2,11H3
InChIKeyYHNBOMKFNANIRQ-UHFFFAOYSA-N
MW174.36 g/mol
LogP1.68
Rot. Bonds7

About 1-hexoxypropylsilane

1-hexoxypropylsilane (PubChem CID 174351834) has the molecular formula C9H22OSi and a molecular weight of 174.36 g/mol. Its IUPAC name is 1-hexoxypropylsilane.

Molecular Properties

Compound Name1-hexoxypropylsilane
PubChem CID174351834
Molecular FormulaC9H22OSi
Molecular Weight174.36 g/mol
Exact Mass174.14
IUPAC Name1-hexoxypropylsilane
SMILESCCCCCCOC([SiH3])CC
InChIInChI=1S/C9H22OSi/c1-3-5-6-7-8-10-9(11)4-2/h9H,3-8H2,1-2,11H3
InChIKeyYHNBOMKFNANIRQ-UHFFFAOYSA-N
XLogP1.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.36
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-hexoxypropylsilane?
The IUPAC name of 1-hexoxypropylsilane (CID 174351834) is 1-hexoxypropylsilane.
What is the SMILES notation for 1-hexoxypropylsilane?
The canonical SMILES for 1-hexoxypropylsilane is CCCCCCOC([SiH3])CC.
What is the InChIKey of 1-hexoxypropylsilane?
The InChIKey is YHNBOMKFNANIRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22OSi/c1-3-5-6-7-8-10-9(11)4-2/h9H,3-8H2,1-2,11H3.
What are the key properties of 1-hexoxypropylsilane?
1-hexoxypropylsilane has a molecular weight of 174.36 g/mol, XLogP of 1.68, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hexoxypropylsilane is sourced from PubChem (CID 174351834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).