chloro-(3,3-dichloropropyl)-methyl-silyloxysilane

C4H11Cl3OSi2 — CID 174775897

IUPACchloro-(3,3-dichloropropyl)-methyl-silyloxysilane
SMILESC[Si](Cl)(CCC(Cl)Cl)O[SiH3]
InChIInChI=1S/C4H11Cl3OSi2/c1-10(7,8-9)3-2-4(5)6/h4H,2-3H2,1,9H3
InChIKeyKRRHNRUHPZMABB-UHFFFAOYSA-N
MW237.66 g/mol
LogP1.79
Rot. Bonds4

About chloro-(3,3-dichloropropyl)-methyl-silyloxysilane

chloro-(3,3-dichloropropyl)-methyl-silyloxysilane (PubChem CID 174775897) has the molecular formula C4H11Cl3OSi2 and a molecular weight of 237.66 g/mol. Its IUPAC name is chloro-(3,3-dichloropropyl)-methyl-silyloxysilane.

Molecular Properties

Compound Namechloro-(3,3-dichloropropyl)-methyl-silyloxysilane
PubChem CID174775897
Molecular FormulaC4H11Cl3OSi2
Molecular Weight237.66 g/mol
Exact Mass235.94
IUPAC Namechloro-(3,3-dichloropropyl)-methyl-silyloxysilane
SMILESC[Si](Cl)(CCC(Cl)Cl)O[SiH3]
InChIInChI=1S/C4H11Cl3OSi2/c1-10(7,8-9)3-2-4(5)6/h4H,2-3H2,1,9H3
InChIKeyKRRHNRUHPZMABB-UHFFFAOYSA-N
XLogP1.79
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.66
LogP ≤ 51.79
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'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of chloro-(3,3-dichloropropyl)-methyl-silyloxysilane?
The IUPAC name of chloro-(3,3-dichloropropyl)-methyl-silyloxysilane (CID 174775897) is chloro-(3,3-dichloropropyl)-methyl-silyloxysilane.
What is the SMILES notation for chloro-(3,3-dichloropropyl)-methyl-silyloxysilane?
The canonical SMILES for chloro-(3,3-dichloropropyl)-methyl-silyloxysilane is C[Si](Cl)(CCC(Cl)Cl)O[SiH3].
What is the InChIKey of chloro-(3,3-dichloropropyl)-methyl-silyloxysilane?
The InChIKey is KRRHNRUHPZMABB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11Cl3OSi2/c1-10(7,8-9)3-2-4(5)6/h4H,2-3H2,1,9H3.
What are the key properties of chloro-(3,3-dichloropropyl)-methyl-silyloxysilane?
chloro-(3,3-dichloropropyl)-methyl-silyloxysilane has a molecular weight of 237.66 g/mol, XLogP of 1.79, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(3,3-dichloropropyl)-methyl-silyloxysilane is sourced from PubChem (CID 174775897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).