1-decoxy-1-methylsilinane

C16H34OSi — CID 620378

IUPAC1-decoxy-1-methylsilinane
SMILESCCCCCCCCCCO[Si]1(C)CCCCC1
InChIInChI=1S/C16H34OSi/c1-3-4-5-6-7-8-9-11-14-17-18(2)15-12-10-13-16-18/h3-16H2,1-2H3
InChIKeyFKTDBRGFPDKAOH-UHFFFAOYSA-N
MW270.53 g/mol
LogP5.90
Rot. Bonds10

About 1-decoxy-1-methylsilinane

1-decoxy-1-methylsilinane (PubChem CID 620378) has the molecular formula C16H34OSi and a molecular weight of 270.53 g/mol. Its IUPAC name is 1-decoxy-1-methylsilinane.

Molecular Properties

Compound Name1-decoxy-1-methylsilinane
PubChem CID620378
Molecular FormulaC16H34OSi
Molecular Weight270.53 g/mol
Exact Mass270.24
IUPAC Name1-decoxy-1-methylsilinane
SMILESCCCCCCCCCCO[Si]1(C)CCCCC1
InChIInChI=1S/C16H34OSi/c1-3-4-5-6-7-8-9-11-14-17-18(2)15-12-10-13-16-18/h3-16H2,1-2H3
InChIKeyFKTDBRGFPDKAOH-UHFFFAOYSA-N
XLogP5.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms18
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.53
LogP ≤ 55.90
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-decoxy-1-methylsilinane?
The IUPAC name of 1-decoxy-1-methylsilinane (CID 620378) is 1-decoxy-1-methylsilinane.
What is the SMILES notation for 1-decoxy-1-methylsilinane?
The canonical SMILES for 1-decoxy-1-methylsilinane is CCCCCCCCCCO[Si]1(C)CCCCC1.
What is the InChIKey of 1-decoxy-1-methylsilinane?
The InChIKey is FKTDBRGFPDKAOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34OSi/c1-3-4-5-6-7-8-9-11-14-17-18(2)15-12-10-13-16-18/h3-16H2,1-2H3.
What are the key properties of 1-decoxy-1-methylsilinane?
1-decoxy-1-methylsilinane has a molecular weight of 270.53 g/mol, XLogP of 5.90, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-decoxy-1-methylsilinane is sourced from PubChem (CID 620378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).