4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane

C13H24OSi — CID 54222513

IUPAC4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane
SMILESC#CCC(CCC)(O[Si](C)(C)C)C1CC1
InChIInChI=1S/C13H24OSi/c1-6-10-13(11-7-2,12-8-9-12)14-15(3,4)5/h1,12H,7-11H2,2-5H3
InChIKeyQDOYISVXIVWDQV-UHFFFAOYSA-N
MW224.42 g/mol
LogP3.81
Rot. Bonds6

About 4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane

4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane (PubChem CID 54222513) has the molecular formula C13H24OSi and a molecular weight of 224.42 g/mol. Its IUPAC name is 4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane.

Molecular Properties

Compound Name4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane
PubChem CID54222513
Molecular FormulaC13H24OSi
Molecular Weight224.42 g/mol
Exact Mass224.16
IUPAC Name4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane
SMILESC#CCC(CCC)(O[Si](C)(C)C)C1CC1
InChIInChI=1S/C13H24OSi/c1-6-10-13(11-7-2,12-8-9-12)14-15(3,4)5/h1,12H,7-11H2,2-5H3
InChIKeyQDOYISVXIVWDQV-UHFFFAOYSA-N
XLogP3.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.42
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'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 4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane?
The IUPAC name of 4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane (CID 54222513) is 4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane.
What is the SMILES notation for 4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane?
The canonical SMILES for 4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane is C#CCC(CCC)(O[Si](C)(C)C)C1CC1.
What is the InChIKey of 4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane?
The InChIKey is QDOYISVXIVWDQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24OSi/c1-6-10-13(11-7-2,12-8-9-12)14-15(3,4)5/h1,12H,7-11H2,2-5H3.
What are the key properties of 4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane?
4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane has a molecular weight of 224.42 g/mol, XLogP of 3.81, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane is sourced from PubChem (CID 54222513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).