butan-2-yloxy-chloro-dimethylsilane

C6H15ClOSi — CID 13033740

IUPACbutan-2-yloxy-chloro-dimethylsilane
SMILESCCC(C)O[Si](C)(C)Cl
InChIInChI=1S/C6H15ClOSi/c1-5-6(2)8-9(3,4)7/h6H,5H2,1-4H3
InChIKeyZMBVAGXDPJIVQD-UHFFFAOYSA-N
MW166.72 g/mol
LogP2.74
Rot. Bonds3

About butan-2-yloxy-chloro-dimethylsilane

butan-2-yloxy-chloro-dimethylsilane (PubChem CID 13033740) has the molecular formula C6H15ClOSi and a molecular weight of 166.72 g/mol. Its IUPAC name is butan-2-yloxy-chloro-dimethylsilane.

Molecular Properties

Compound Namebutan-2-yloxy-chloro-dimethylsilane
PubChem CID13033740
Molecular FormulaC6H15ClOSi
Molecular Weight166.72 g/mol
Exact Mass166.06
IUPAC Namebutan-2-yloxy-chloro-dimethylsilane
SMILESCCC(C)O[Si](C)(C)Cl
InChIInChI=1S/C6H15ClOSi/c1-5-6(2)8-9(3,4)7/h6H,5H2,1-4H3
InChIKeyZMBVAGXDPJIVQD-UHFFFAOYSA-N
XLogP2.74
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.72
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 butan-2-yloxy-chloro-dimethylsilane?
The IUPAC name of butan-2-yloxy-chloro-dimethylsilane (CID 13033740) is butan-2-yloxy-chloro-dimethylsilane.
What is the SMILES notation for butan-2-yloxy-chloro-dimethylsilane?
The canonical SMILES for butan-2-yloxy-chloro-dimethylsilane is CCC(C)O[Si](C)(C)Cl.
What is the InChIKey of butan-2-yloxy-chloro-dimethylsilane?
The InChIKey is ZMBVAGXDPJIVQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15ClOSi/c1-5-6(2)8-9(3,4)7/h6H,5H2,1-4H3.
What are the key properties of butan-2-yloxy-chloro-dimethylsilane?
butan-2-yloxy-chloro-dimethylsilane has a molecular weight of 166.72 g/mol, XLogP of 2.74, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butan-2-yloxy-chloro-dimethylsilane is sourced from PubChem (CID 13033740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).