dichloromethyl-dimethyl-octan-4-yloxysilane

C11H24Cl2OSi — CID 554622

IUPACdichloromethyl-dimethyl-octan-4-yloxysilane
SMILESCCCCC(CCC)O[Si](C)(C)C(Cl)Cl
InChIInChI=1S/C11H24Cl2OSi/c1-5-7-9-10(8-6-2)14-15(3,4)11(12)13/h10-11H,5-9H2,1-4H3
InChIKeyVPHHHUDFIUENDV-UHFFFAOYSA-N
MW271.30 g/mol
LogP4.91
Rot. Bonds8

About dichloromethyl-dimethyl-octan-4-yloxysilane

dichloromethyl-dimethyl-octan-4-yloxysilane (PubChem CID 554622) has the molecular formula C11H24Cl2OSi and a molecular weight of 271.30 g/mol. Its IUPAC name is dichloromethyl-dimethyl-octan-4-yloxysilane.

Molecular Properties

Compound Namedichloromethyl-dimethyl-octan-4-yloxysilane
PubChem CID554622
Molecular FormulaC11H24Cl2OSi
Molecular Weight271.30 g/mol
Exact Mass270.10
IUPAC Namedichloromethyl-dimethyl-octan-4-yloxysilane
SMILESCCCCC(CCC)O[Si](C)(C)C(Cl)Cl
InChIInChI=1S/C11H24Cl2OSi/c1-5-7-9-10(8-6-2)14-15(3,4)11(12)13/h10-11H,5-9H2,1-4H3
InChIKeyVPHHHUDFIUENDV-UHFFFAOYSA-N
XLogP4.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.30
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dichloromethyl-dimethyl-octan-4-yloxysilane?
The IUPAC name of dichloromethyl-dimethyl-octan-4-yloxysilane (CID 554622) is dichloromethyl-dimethyl-octan-4-yloxysilane.
What is the SMILES notation for dichloromethyl-dimethyl-octan-4-yloxysilane?
The canonical SMILES for dichloromethyl-dimethyl-octan-4-yloxysilane is CCCCC(CCC)O[Si](C)(C)C(Cl)Cl.
What is the InChIKey of dichloromethyl-dimethyl-octan-4-yloxysilane?
The InChIKey is VPHHHUDFIUENDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24Cl2OSi/c1-5-7-9-10(8-6-2)14-15(3,4)11(12)13/h10-11H,5-9H2,1-4H3.
What are the key properties of dichloromethyl-dimethyl-octan-4-yloxysilane?
dichloromethyl-dimethyl-octan-4-yloxysilane has a molecular weight of 271.30 g/mol, XLogP of 4.91, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloromethyl-dimethyl-octan-4-yloxysilane is sourced from PubChem (CID 554622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).