tributoxy(prop-2-ynyl)silane

C15H30O3Si — CID 87207313

IUPACtributoxy(prop-2-ynyl)silane
SMILESC#CC[Si](OCCCC)(OCCCC)OCCCC
InChIInChI=1S/C15H30O3Si/c1-5-9-12-16-19(15-8-4,17-13-10-6-2)18-14-11-7-3/h4H,5-7,9-15H2,1-3H3
InChIKeyNMOMPKWSSOKPGE-UHFFFAOYSA-N
MW286.49 g/mol
LogP4.01
Rot. Bonds13

About tributoxy(prop-2-ynyl)silane

tributoxy(prop-2-ynyl)silane (PubChem CID 87207313) has the molecular formula C15H30O3Si and a molecular weight of 286.49 g/mol. Its IUPAC name is tributoxy(prop-2-ynyl)silane.

Molecular Properties

Compound Nametributoxy(prop-2-ynyl)silane
PubChem CID87207313
Molecular FormulaC15H30O3Si
Molecular Weight286.49 g/mol
Exact Mass286.20
IUPAC Nametributoxy(prop-2-ynyl)silane
SMILESC#CC[Si](OCCCC)(OCCCC)OCCCC
InChIInChI=1S/C15H30O3Si/c1-5-9-12-16-19(15-8-4,17-13-10-6-2)18-14-11-7-3/h4H,5-7,9-15H2,1-3H3
InChIKeyNMOMPKWSSOKPGE-UHFFFAOYSA-N
XLogP4.01
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.49
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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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Frequently Asked Questions

What is the IUPAC name of tributoxy(prop-2-ynyl)silane?
The IUPAC name of tributoxy(prop-2-ynyl)silane (CID 87207313) is tributoxy(prop-2-ynyl)silane.
What is the SMILES notation for tributoxy(prop-2-ynyl)silane?
The canonical SMILES for tributoxy(prop-2-ynyl)silane is C#CC[Si](OCCCC)(OCCCC)OCCCC.
What is the InChIKey of tributoxy(prop-2-ynyl)silane?
The InChIKey is NMOMPKWSSOKPGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O3Si/c1-5-9-12-16-19(15-8-4,17-13-10-6-2)18-14-11-7-3/h4H,5-7,9-15H2,1-3H3.
What are the key properties of tributoxy(prop-2-ynyl)silane?
tributoxy(prop-2-ynyl)silane has a molecular weight of 286.49 g/mol, XLogP of 4.01, 13 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tributoxy(prop-2-ynyl)silane is sourced from PubChem (CID 87207313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).