butan-2-yloxy-(3,5-dimethylphenyl)silane

C12H20OSi — CID 173101684

IUPACbutan-2-yloxy-(3,5-dimethylphenyl)silane
SMILESCCC(C)O[SiH2]c1cc(C)cc(C)c1
InChIInChI=1S/C12H20OSi/c1-5-11(4)13-14-12-7-9(2)6-10(3)8-12/h6-8,11H,5,14H2,1-4H3
InChIKeyWYINHUYNIQNNHJ-UHFFFAOYSA-N
MW208.38 g/mol
LogP1.83
Rot. Bonds4

About butan-2-yloxy-(3,5-dimethylphenyl)silane

butan-2-yloxy-(3,5-dimethylphenyl)silane (PubChem CID 173101684) has the molecular formula C12H20OSi and a molecular weight of 208.38 g/mol. Its IUPAC name is butan-2-yloxy-(3,5-dimethylphenyl)silane.

Molecular Properties

Compound Namebutan-2-yloxy-(3,5-dimethylphenyl)silane
PubChem CID173101684
Molecular FormulaC12H20OSi
Molecular Weight208.38 g/mol
Exact Mass208.13
IUPAC Namebutan-2-yloxy-(3,5-dimethylphenyl)silane
SMILESCCC(C)O[SiH2]c1cc(C)cc(C)c1
InChIInChI=1S/C12H20OSi/c1-5-11(4)13-14-12-7-9(2)6-10(3)8-12/h6-8,11H,5,14H2,1-4H3
InChIKeyWYINHUYNIQNNHJ-UHFFFAOYSA-N
XLogP1.83
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.38
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of butan-2-yloxy-(3,5-dimethylphenyl)silane?
The IUPAC name of butan-2-yloxy-(3,5-dimethylphenyl)silane (CID 173101684) is butan-2-yloxy-(3,5-dimethylphenyl)silane.
What is the SMILES notation for butan-2-yloxy-(3,5-dimethylphenyl)silane?
The canonical SMILES for butan-2-yloxy-(3,5-dimethylphenyl)silane is CCC(C)O[SiH2]c1cc(C)cc(C)c1.
What is the InChIKey of butan-2-yloxy-(3,5-dimethylphenyl)silane?
The InChIKey is WYINHUYNIQNNHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20OSi/c1-5-11(4)13-14-12-7-9(2)6-10(3)8-12/h6-8,11H,5,14H2,1-4H3.
What are the key properties of butan-2-yloxy-(3,5-dimethylphenyl)silane?
butan-2-yloxy-(3,5-dimethylphenyl)silane has a molecular weight of 208.38 g/mol, XLogP of 1.83, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butan-2-yloxy-(3,5-dimethylphenyl)silane is sourced from PubChem (CID 173101684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).