butan-2-yloxy(methyl)silane

C5H14OSi — CID 123678564

IUPACbutan-2-yloxy(methyl)silane
SMILESCCC(C)O[SiH2]C
InChIInChI=1S/C5H14OSi/c1-4-5(2)6-7-3/h5H,4,7H2,1-3H3
InChIKeyJVVAQVLBGDTDDH-UHFFFAOYSA-N
MW118.25 g/mol
LogP0.93
Rot. Bonds3

About butan-2-yloxy(methyl)silane

butan-2-yloxy(methyl)silane (PubChem CID 123678564) has the molecular formula C5H14OSi and a molecular weight of 118.25 g/mol. Its IUPAC name is butan-2-yloxy(methyl)silane.

Molecular Properties

Compound Namebutan-2-yloxy(methyl)silane
PubChem CID123678564
Molecular FormulaC5H14OSi
Molecular Weight118.25 g/mol
Exact Mass118.08
IUPAC Namebutan-2-yloxy(methyl)silane
SMILESCCC(C)O[SiH2]C
InChIInChI=1S/C5H14OSi/c1-4-5(2)6-7-3/h5H,4,7H2,1-3H3
InChIKeyJVVAQVLBGDTDDH-UHFFFAOYSA-N
XLogP0.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.25
LogP ≤ 50.93
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(methyl)silane?
The IUPAC name of butan-2-yloxy(methyl)silane (CID 123678564) is butan-2-yloxy(methyl)silane.
What is the SMILES notation for butan-2-yloxy(methyl)silane?
The canonical SMILES for butan-2-yloxy(methyl)silane is CCC(C)O[SiH2]C.
What is the InChIKey of butan-2-yloxy(methyl)silane?
The InChIKey is JVVAQVLBGDTDDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14OSi/c1-4-5(2)6-7-3/h5H,4,7H2,1-3H3.
What are the key properties of butan-2-yloxy(methyl)silane?
butan-2-yloxy(methyl)silane has a molecular weight of 118.25 g/mol, XLogP of 0.93, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butan-2-yloxy(methyl)silane is sourced from PubChem (CID 123678564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).