butoxysilane;dimethoxy(methyl)silane

C7H22O3Si2 — CID 158475747

IUPACbutoxysilane;dimethoxy(methyl)silane
SMILESCCCCO[SiH3].CO[SiH](C)OC
InChIInChI=1S/C4H12OSi.C3H10O2Si/c1-2-3-4-5-6;1-4-6(3)5-2/h2-4H2,1,6H3;6H,1-3H3
InChIKeyHGXGWSHZJXBJMB-UHFFFAOYSA-N
MW210.42 g/mol
LogP0.21
Rot. Bonds5

About butoxysilane;dimethoxy(methyl)silane

butoxysilane;dimethoxy(methyl)silane (PubChem CID 158475747) has the molecular formula C7H22O3Si2 and a molecular weight of 210.42 g/mol. Its IUPAC name is butoxysilane;dimethoxy(methyl)silane.

Molecular Properties

Compound Namebutoxysilane;dimethoxy(methyl)silane
PubChem CID158475747
Molecular FormulaC7H22O3Si2
Molecular Weight210.42 g/mol
Exact Mass210.11
IUPAC Namebutoxysilane;dimethoxy(methyl)silane
SMILESCCCCO[SiH3].CO[SiH](C)OC
InChIInChI=1S/C4H12OSi.C3H10O2Si/c1-2-3-4-5-6;1-4-6(3)5-2/h2-4H2,1,6H3;6H,1-3H3
InChIKeyHGXGWSHZJXBJMB-UHFFFAOYSA-N
XLogP0.21
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.42
LogP ≤ 50.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze butoxysilane;dimethoxy(methyl)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of butoxysilane;dimethoxy(methyl)silane?
The IUPAC name of butoxysilane;dimethoxy(methyl)silane (CID 158475747) is butoxysilane;dimethoxy(methyl)silane.
What is the SMILES notation for butoxysilane;dimethoxy(methyl)silane?
The canonical SMILES for butoxysilane;dimethoxy(methyl)silane is CCCCO[SiH3].CO[SiH](C)OC.
What is the InChIKey of butoxysilane;dimethoxy(methyl)silane?
The InChIKey is HGXGWSHZJXBJMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12OSi.C3H10O2Si/c1-2-3-4-5-6;1-4-6(3)5-2/h2-4H2,1,6H3;6H,1-3H3.
What are the key properties of butoxysilane;dimethoxy(methyl)silane?
butoxysilane;dimethoxy(methyl)silane has a molecular weight of 210.42 g/mol, XLogP of 0.21, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for butoxysilane;dimethoxy(methyl)silane is sourced from PubChem (CID 158475747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).