2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane

C13H30O4Si — CID 91522026

IUPAC2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane
SMILESCCCCOCCO[Si](C)(C)OCCOCCC
InChIInChI=1S/C13H30O4Si/c1-5-7-9-15-11-13-17-18(3,4)16-12-10-14-8-6-2/h5-13H2,1-4H3
InChIKeyUERHDFCYSUMRGW-UHFFFAOYSA-N
MW278.46 g/mol
LogP2.96
Rot. Bonds13

About 2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane

2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane (PubChem CID 91522026) has the molecular formula C13H30O4Si and a molecular weight of 278.46 g/mol. Its IUPAC name is 2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane.

Molecular Properties

Compound Name2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane
PubChem CID91522026
Molecular FormulaC13H30O4Si
Molecular Weight278.46 g/mol
Exact Mass278.19
IUPAC Name2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane
SMILESCCCCOCCO[Si](C)(C)OCCOCCC
InChIInChI=1S/C13H30O4Si/c1-5-7-9-15-11-13-17-18(3,4)16-12-10-14-8-6-2/h5-13H2,1-4H3
InChIKeyUERHDFCYSUMRGW-UHFFFAOYSA-N
XLogP2.96
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.46
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane?
The IUPAC name of 2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane (CID 91522026) is 2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane.
What is the SMILES notation for 2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane?
The canonical SMILES for 2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane is CCCCOCCO[Si](C)(C)OCCOCCC.
What is the InChIKey of 2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane?
The InChIKey is UERHDFCYSUMRGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30O4Si/c1-5-7-9-15-11-13-17-18(3,4)16-12-10-14-8-6-2/h5-13H2,1-4H3.
What are the key properties of 2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane?
2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane has a molecular weight of 278.46 g/mol, XLogP of 2.96, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane is sourced from PubChem (CID 91522026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).