chloro-methyl-bis(2-methylbutoxy)silane

C11H25ClO2Si — CID 54460753

IUPACchloro-methyl-bis(2-methylbutoxy)silane
SMILESCCC(C)CO[Si](C)(Cl)OCC(C)CC
InChIInChI=1S/C11H25ClO2Si/c1-6-10(3)8-13-15(5,12)14-9-11(4)7-2/h10-11H,6-9H2,1-5H3
InChIKeyXBKUZWWEJSDSOQ-UHFFFAOYSA-N
MW252.86 g/mol
LogP3.92
Rot. Bonds8

About chloro-methyl-bis(2-methylbutoxy)silane

chloro-methyl-bis(2-methylbutoxy)silane (PubChem CID 54460753) has the molecular formula C11H25ClO2Si and a molecular weight of 252.86 g/mol. Its IUPAC name is chloro-methyl-bis(2-methylbutoxy)silane.

Molecular Properties

Compound Namechloro-methyl-bis(2-methylbutoxy)silane
PubChem CID54460753
Molecular FormulaC11H25ClO2Si
Molecular Weight252.86 g/mol
Exact Mass252.13
IUPAC Namechloro-methyl-bis(2-methylbutoxy)silane
SMILESCCC(C)CO[Si](C)(Cl)OCC(C)CC
InChIInChI=1S/C11H25ClO2Si/c1-6-10(3)8-13-15(5,12)14-9-11(4)7-2/h10-11H,6-9H2,1-5H3
InChIKeyXBKUZWWEJSDSOQ-UHFFFAOYSA-N
XLogP3.92
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.86
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro-methyl-bis(2-methylbutoxy)silane?
The IUPAC name of chloro-methyl-bis(2-methylbutoxy)silane (CID 54460753) is chloro-methyl-bis(2-methylbutoxy)silane.
What is the SMILES notation for chloro-methyl-bis(2-methylbutoxy)silane?
The canonical SMILES for chloro-methyl-bis(2-methylbutoxy)silane is CCC(C)CO[Si](C)(Cl)OCC(C)CC.
What is the InChIKey of chloro-methyl-bis(2-methylbutoxy)silane?
The InChIKey is XBKUZWWEJSDSOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25ClO2Si/c1-6-10(3)8-13-15(5,12)14-9-11(4)7-2/h10-11H,6-9H2,1-5H3.
What are the key properties of chloro-methyl-bis(2-methylbutoxy)silane?
chloro-methyl-bis(2-methylbutoxy)silane has a molecular weight of 252.86 g/mol, XLogP of 3.92, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-methyl-bis(2-methylbutoxy)silane is sourced from PubChem (CID 54460753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).