butyl-methoxy-(2-methylprop-2-enoxy)silane

C9H20O2Si — CID 173115698

IUPACbutyl-methoxy-(2-methylprop-2-enoxy)silane
SMILESC=C(C)CO[SiH](CCCC)OC
InChIInChI=1S/C9H20O2Si/c1-5-6-7-12(10-4)11-8-9(2)3/h12H,2,5-8H2,1,3-4H3
InChIKeyXRMUCNDVYBSIBV-UHFFFAOYSA-N
MW188.34 g/mol
LogP2.25
Rot. Bonds7

About butyl-methoxy-(2-methylprop-2-enoxy)silane

butyl-methoxy-(2-methylprop-2-enoxy)silane (PubChem CID 173115698) has the molecular formula C9H20O2Si and a molecular weight of 188.34 g/mol. Its IUPAC name is butyl-methoxy-(2-methylprop-2-enoxy)silane.

Molecular Properties

Compound Namebutyl-methoxy-(2-methylprop-2-enoxy)silane
PubChem CID173115698
Molecular FormulaC9H20O2Si
Molecular Weight188.34 g/mol
Exact Mass188.12
IUPAC Namebutyl-methoxy-(2-methylprop-2-enoxy)silane
SMILESC=C(C)CO[SiH](CCCC)OC
InChIInChI=1S/C9H20O2Si/c1-5-6-7-12(10-4)11-8-9(2)3/h12H,2,5-8H2,1,3-4H3
InChIKeyXRMUCNDVYBSIBV-UHFFFAOYSA-N
XLogP2.25
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.34
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of butyl-methoxy-(2-methylprop-2-enoxy)silane?
The IUPAC name of butyl-methoxy-(2-methylprop-2-enoxy)silane (CID 173115698) is butyl-methoxy-(2-methylprop-2-enoxy)silane.
What is the SMILES notation for butyl-methoxy-(2-methylprop-2-enoxy)silane?
The canonical SMILES for butyl-methoxy-(2-methylprop-2-enoxy)silane is C=C(C)CO[SiH](CCCC)OC.
What is the InChIKey of butyl-methoxy-(2-methylprop-2-enoxy)silane?
The InChIKey is XRMUCNDVYBSIBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O2Si/c1-5-6-7-12(10-4)11-8-9(2)3/h12H,2,5-8H2,1,3-4H3.
What are the key properties of butyl-methoxy-(2-methylprop-2-enoxy)silane?
butyl-methoxy-(2-methylprop-2-enoxy)silane has a molecular weight of 188.34 g/mol, XLogP of 2.25, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-methoxy-(2-methylprop-2-enoxy)silane is sourced from PubChem (CID 173115698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).