butoxy-butyl-methoxysilane

C9H22O2Si — CID 154072668

IUPACbutoxy-butyl-methoxysilane
SMILESCCCCO[SiH](CCCC)OC
InChIInChI=1S/C9H22O2Si/c1-4-6-8-11-12(10-3)9-7-5-2/h12H,4-9H2,1-3H3
InChIKeyWDBMJZACXMPKSY-UHFFFAOYSA-N
MW190.36 g/mol
LogP2.47
Rot. Bonds8

About butoxy-butyl-methoxysilane

butoxy-butyl-methoxysilane (PubChem CID 154072668) has the molecular formula C9H22O2Si and a molecular weight of 190.36 g/mol. Its IUPAC name is butoxy-butyl-methoxysilane.

Molecular Properties

Compound Namebutoxy-butyl-methoxysilane
PubChem CID154072668
Molecular FormulaC9H22O2Si
Molecular Weight190.36 g/mol
Exact Mass190.14
IUPAC Namebutoxy-butyl-methoxysilane
SMILESCCCCO[SiH](CCCC)OC
InChIInChI=1S/C9H22O2Si/c1-4-6-8-11-12(10-3)9-7-5-2/h12H,4-9H2,1-3H3
InChIKeyWDBMJZACXMPKSY-UHFFFAOYSA-N
XLogP2.47
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.36
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

dibutoxy(3-dibutoxysilylpropyl)silane
CID 123992864
butoxy-methoxy-(2-methylpropyl)silane
CID 154072679
3-dipentoxysilylpropyl(dipentoxy)silane
CID 123859896
butyl-methoxy-(2-methylprop-2-enoxy)silane
CID 173115698
heptadecyl(dimethoxy)silane
CID 173012112
dimethoxy(nonyl)silane
CID 154057580
docosyl(dimethoxy)silane
CID 150688039
dimethoxy(pentyl)silane;methanamine
CID 175165037
dipentoxy(propyl)silane
CID 123345702
1-[butoxy(methoxy)silyl]octan-3-yl prop-2-enoate
CID 123684562
dimethoxy(pentyl)silane;propan-2-amine
CID 175239274
3-diethoxysilylpropyl(dimethoxy)silane
CID 59537920

Frequently Asked Questions

What is the IUPAC name of butoxy-butyl-methoxysilane?
The IUPAC name of butoxy-butyl-methoxysilane (CID 154072668) is butoxy-butyl-methoxysilane.
What is the SMILES notation for butoxy-butyl-methoxysilane?
The canonical SMILES for butoxy-butyl-methoxysilane is CCCCO[SiH](CCCC)OC.
What is the InChIKey of butoxy-butyl-methoxysilane?
The InChIKey is WDBMJZACXMPKSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22O2Si/c1-4-6-8-11-12(10-3)9-7-5-2/h12H,4-9H2,1-3H3.
What are the key properties of butoxy-butyl-methoxysilane?
butoxy-butyl-methoxysilane has a molecular weight of 190.36 g/mol, XLogP of 2.47, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-butyl-methoxysilane is sourced from PubChem (CID 154072668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).