4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane

C13H23FOSi — CID 12801788

IUPAC4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane
SMILESC#CCC(CCCC)(O[Si](C)(C)C)C(=C)F
InChIInChI=1S/C13H23FOSi/c1-7-9-11-13(10-8-2,12(3)14)15-16(4,5)6/h2H,3,7,9-11H2,1,4-6H3
InChIKeyFAOKMWPYFUKXBC-UHFFFAOYSA-N
MW242.41 g/mol
LogP4.27
Rot. Bonds7

About 4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane

4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane (PubChem CID 12801788) has the molecular formula C13H23FOSi and a molecular weight of 242.41 g/mol. Its IUPAC name is 4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane.

Molecular Properties

Compound Name4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane
PubChem CID12801788
Molecular FormulaC13H23FOSi
Molecular Weight242.41 g/mol
Exact Mass242.15
IUPAC Name4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane
SMILESC#CCC(CCCC)(O[Si](C)(C)C)C(=C)F
InChIInChI=1S/C13H23FOSi/c1-7-9-11-13(10-8-2,12(3)14)15-16(4,5)6/h2H,3,7,9-11H2,1,4-6H3
InChIKeyFAOKMWPYFUKXBC-UHFFFAOYSA-N
XLogP4.27
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 54.27
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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Related Compounds

trimethyl(2-methylpent-4-yn-2-yloxy)silane
CID 11708134
3-butyl-3-trimethylsilyloxyheptanenitrile
CID 87839604
4-cyclopropylhept-1-yn-4-yloxy(trimethyl)silane
CID 54222513
diethyl 2-butyl-2-prop-2-ynylpropanedioate
CID 12020975
2-butyl-2-[difluoro(methyl)silyl]propanedinitrile
CID 140812693
4-methyldec-1-yn-4-ol
CID 12573338
(1-cyclopropyl-3-methylhex-5-yn-3-yl)oxy-trimethylsilane
CID 13387951
2-fluoro-3-(2-methylphenyl)hept-1-en-3-ol
CID 135002141
3-ethynyl-2-methyloct-1-en-3-ol
CID 71390392
trimethyl-(1-silyloxy-1-trimethylsilyloxyundecoxy)silane
CID 123304582
trimethyl-[(Z)-5-methylnon-2-en-5-yl]oxysilane
CID 161469937
4,4-dimethylhept-1-yne
CID 54097689

Frequently Asked Questions

What is the IUPAC name of 4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane?
The IUPAC name of 4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane (CID 12801788) is 4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane.
What is the SMILES notation for 4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane?
The canonical SMILES for 4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane is C#CCC(CCCC)(O[Si](C)(C)C)C(=C)F.
What is the InChIKey of 4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane?
The InChIKey is FAOKMWPYFUKXBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23FOSi/c1-7-9-11-13(10-8-2,12(3)14)15-16(4,5)6/h2H,3,7,9-11H2,1,4-6H3.
What are the key properties of 4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane?
4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane has a molecular weight of 242.41 g/mol, XLogP of 4.27, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-fluoroethenyl)oct-1-yn-4-yloxy-trimethylsilane is sourced from PubChem (CID 12801788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).