(2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane

C10H19ClO2Si — CID 22623698

IUPAC(2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane
SMILESCO[Si](OC)(C1CCC1)C1CCC1Cl
InChIInChI=1S/C10H19ClO2Si/c1-12-14(13-2,8-4-3-5-8)10-7-6-9(10)11/h8-10H,3-7H2,1-2H3
InChIKeyXNRIVEQWWBYVES-UHFFFAOYSA-N
MW234.80 g/mol
LogP3.05
Rot. Bonds4

About (2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane

(2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane (PubChem CID 22623698) has the molecular formula C10H19ClO2Si and a molecular weight of 234.80 g/mol. Its IUPAC name is (2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane.

Molecular Properties

Compound Name(2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane
PubChem CID22623698
Molecular FormulaC10H19ClO2Si
Molecular Weight234.80 g/mol
Exact Mass234.08
IUPAC Name(2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane
SMILESCO[Si](OC)(C1CCC1)C1CCC1Cl
InChIInChI=1S/C10H19ClO2Si/c1-12-14(13-2,8-4-3-5-8)10-7-6-9(10)11/h8-10H,3-7H2,1-2H3
InChIKeyXNRIVEQWWBYVES-UHFFFAOYSA-N
XLogP3.05
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.80
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 (2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane?
The IUPAC name of (2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane (CID 22623698) is (2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane.
What is the SMILES notation for (2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane?
The canonical SMILES for (2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane is CO[Si](OC)(C1CCC1)C1CCC1Cl.
What is the InChIKey of (2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane?
The InChIKey is XNRIVEQWWBYVES-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19ClO2Si/c1-12-14(13-2,8-4-3-5-8)10-7-6-9(10)11/h8-10H,3-7H2,1-2H3.
What are the key properties of (2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane?
(2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane has a molecular weight of 234.80 g/mol, XLogP of 3.05, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorocyclobutyl)-cyclobutyl-dimethoxysilane is sourced from PubChem (CID 22623698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).