butoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane

C10H23ClOSi — CID 88521486

IUPACbutoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane
SMILESCCCCO[Si](C)(C)C(C)(C)CCl
InChIInChI=1S/C10H23ClOSi/c1-6-7-8-12-13(4,5)10(2,3)9-11/h6-9H2,1-5H3
InChIKeyBYXIWFVWEADKIU-UHFFFAOYSA-N
MW222.83 g/mol
LogP4.03
Rot. Bonds6

About butoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane

butoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane (PubChem CID 88521486) has the molecular formula C10H23ClOSi and a molecular weight of 222.83 g/mol. Its IUPAC name is butoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane.

Molecular Properties

Compound Namebutoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane
PubChem CID88521486
Molecular FormulaC10H23ClOSi
Molecular Weight222.83 g/mol
Exact Mass222.12
IUPAC Namebutoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane
SMILESCCCCO[Si](C)(C)C(C)(C)CCl
InChIInChI=1S/C10H23ClOSi/c1-6-7-8-12-13(4,5)10(2,3)9-11/h6-9H2,1-5H3
InChIKeyBYXIWFVWEADKIU-UHFFFAOYSA-N
XLogP4.03
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.83
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 butoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane?
The IUPAC name of butoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane (CID 88521486) is butoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane.
What is the SMILES notation for butoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane?
The canonical SMILES for butoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane is CCCCO[Si](C)(C)C(C)(C)CCl.
What is the InChIKey of butoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane?
The InChIKey is BYXIWFVWEADKIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23ClOSi/c1-6-7-8-12-13(4,5)10(2,3)9-11/h6-9H2,1-5H3.
What are the key properties of butoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane?
butoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane has a molecular weight of 222.83 g/mol, XLogP of 4.03, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-(1-chloro-2-methylpropan-2-yl)-dimethylsilane is sourced from PubChem (CID 88521486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).