3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile

C7H19NO2Si3 — CID 173458077

IUPAC3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile
SMILESCC(C#N)C[SiH](C)O[Si](C)(C)O[SiH3]
InChIInChI=1S/C7H19NO2Si3/c1-7(5-8)6-12(2)10-13(3,4)9-11/h7,12H,6H2,1-4,11H3
InChIKeyMZSHLGKPCFXAIV-UHFFFAOYSA-N
MW233.49 g/mol
LogP0.52
Rot. Bonds5

About 3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile

3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile (PubChem CID 173458077) has the molecular formula C7H19NO2Si3 and a molecular weight of 233.49 g/mol. Its IUPAC name is 3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile.

Molecular Properties

Compound Name3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile
PubChem CID173458077
Molecular FormulaC7H19NO2Si3
Molecular Weight233.49 g/mol
Exact Mass233.07
IUPAC Name3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile
SMILESCC(C#N)C[SiH](C)O[Si](C)(C)O[SiH3]
InChIInChI=1S/C7H19NO2Si3/c1-7(5-8)6-12(2)10-13(3,4)9-11/h7,12H,6H2,1-4,11H3
InChIKeyMZSHLGKPCFXAIV-UHFFFAOYSA-N
XLogP0.52
TPSA42.25 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.49
LogP ≤ 50.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile?
The IUPAC name of 3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile (CID 173458077) is 3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile.
What is the SMILES notation for 3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile?
The canonical SMILES for 3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile is CC(C#N)C[SiH](C)O[Si](C)(C)O[SiH3].
What is the InChIKey of 3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile?
The InChIKey is MZSHLGKPCFXAIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H19NO2Si3/c1-7(5-8)6-12(2)10-13(3,4)9-11/h7,12H,6H2,1-4,11H3.
What are the key properties of 3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile?
3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile has a molecular weight of 233.49 g/mol, XLogP of 0.52, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[dimethyl(silyloxy)silyl]oxy-methylsilyl]-2-methylpropanenitrile is sourced from PubChem (CID 173458077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).