but-3-ynoxy(dimethyl)silane

C6H12OSi — CID 170849294

IUPACbut-3-ynoxy(dimethyl)silane
SMILESC#CCCO[SiH](C)C
InChIInChI=1S/C6H12OSi/c1-4-5-6-7-8(2)3/h1,8H,5-6H2,2-3H3
InChIKeyJEYBLQQWRPUGSE-UHFFFAOYSA-N
MW128.25 g/mol
LogP1.01
Rot. Bonds3

About but-3-ynoxy(dimethyl)silane

but-3-ynoxy(dimethyl)silane (PubChem CID 170849294) has the molecular formula C6H12OSi and a molecular weight of 128.25 g/mol. Its IUPAC name is but-3-ynoxy(dimethyl)silane.

Molecular Properties

Compound Namebut-3-ynoxy(dimethyl)silane
PubChem CID170849294
Molecular FormulaC6H12OSi
Molecular Weight128.25 g/mol
Exact Mass128.07
IUPAC Namebut-3-ynoxy(dimethyl)silane
SMILESC#CCCO[SiH](C)C
InChIInChI=1S/C6H12OSi/c1-4-5-6-7-8(2)3/h1,8H,5-6H2,2-3H3
InChIKeyJEYBLQQWRPUGSE-UHFFFAOYSA-N
XLogP1.01
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.25
LogP ≤ 51.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Silane, trimethyl(2-propyn-1-yloxy)-
CID 79696
3-(Trimethylsilyloxy)-1-butyne
CID 28817
1-Trimethylsilyloxy-3-butyne
CID 2760858
[(2S)-but-3-yn-2-yl]oxy-trimethylsilane
CID 10953626
But-3-ynoxy-di(propan-2-yl)silane
CID 101254491
Silane, (3-butynyloxy)tris(1-methylethyl)-
CID 10857164
Diisopropyl-(3-pentynyloxy)silane
CID 59925975
Methyl-bis(prop-2-ynoxy)silane
CID 170847768
Dimethyl(prop-2-ynoxy)silane
CID 154447139
Trimethyl(pent-4-ynoxy)silane
CID 2760859
Trimethyl[[(1R)-1-methyl-2-propyn-1-yl]oxy]silane
CID 12012524
But-2-ynoxy(trimethyl)silane
CID 13950819

Frequently Asked Questions

What is the IUPAC name of but-3-ynoxy(dimethyl)silane?
The IUPAC name of but-3-ynoxy(dimethyl)silane (CID 170849294) is but-3-ynoxy(dimethyl)silane.
What is the SMILES notation for but-3-ynoxy(dimethyl)silane?
The canonical SMILES for but-3-ynoxy(dimethyl)silane is C#CCCO[SiH](C)C.
What is the InChIKey of but-3-ynoxy(dimethyl)silane?
The InChIKey is JEYBLQQWRPUGSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12OSi/c1-4-5-6-7-8(2)3/h1,8H,5-6H2,2-3H3.
What are the key properties of but-3-ynoxy(dimethyl)silane?
but-3-ynoxy(dimethyl)silane has a molecular weight of 128.25 g/mol, XLogP of 1.01, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for but-3-ynoxy(dimethyl)silane is sourced from PubChem (CID 170849294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).