3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane

C16H30O3Si2 — CID 11393251

IUPAC3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane
SMILESCC(C)O[Si](C)(C)C#CCOCC#C[Si](C)(C)OC(C)C
InChIInChI=1S/C16H30O3Si2/c1-15(2)18-20(5,6)13-9-11-17-12-10-14-21(7,8)19-16(3)4/h15-16H,11-12H2,1-8H3
InChIKeyVNCYOVPGSLMXAT-UHFFFAOYSA-N
MW326.59 g/mol
LogP3.35
Rot. Bonds6

About 3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane

3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane (PubChem CID 11393251) has the molecular formula C16H30O3Si2 and a molecular weight of 326.59 g/mol. Its IUPAC name is 3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane.

Molecular Properties

Compound Name3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane
PubChem CID11393251
Molecular FormulaC16H30O3Si2
Molecular Weight326.59 g/mol
Exact Mass326.17
IUPAC Name3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane
SMILESCC(C)O[Si](C)(C)C#CCOCC#C[Si](C)(C)OC(C)C
InChIInChI=1S/C16H30O3Si2/c1-15(2)18-20(5,6)13-9-11-17-12-10-14-21(7,8)19-16(3)4/h15-16H,11-12H2,1-8H3
InChIKeyVNCYOVPGSLMXAT-UHFFFAOYSA-N
XLogP3.35
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.59
LogP ≤ 53.35
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 3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane?
The IUPAC name of 3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane (CID 11393251) is 3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane.
What is the SMILES notation for 3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane?
The canonical SMILES for 3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane is CC(C)O[Si](C)(C)C#CCOCC#C[Si](C)(C)OC(C)C.
What is the InChIKey of 3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane?
The InChIKey is VNCYOVPGSLMXAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30O3Si2/c1-15(2)18-20(5,6)13-9-11-17-12-10-14-21(7,8)19-16(3)4/h15-16H,11-12H2,1-8H3.
What are the key properties of 3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane?
3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane has a molecular weight of 326.59 g/mol, XLogP of 3.35, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[dimethyl(propan-2-yloxy)silyl]prop-2-ynoxy]prop-1-ynyl-dimethyl-propan-2-yloxysilane is sourced from PubChem (CID 11393251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).