hydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane

C10H18F3OSi+ — CID 175195405

IUPAChydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane
SMILESC[SiH2]C1(CC=CC(F)(F)F)CCCCO1.[H+]
InChIInChI=1S/C10H17F3OSi/c1-15-9(5-2-3-8-14-9)6-4-7-10(11,12)13/h4,7H,2-3,5-6,8,15H2,1H3/p+1
InChIKeySQTXVKQUELDNIB-UHFFFAOYSA-O
MW239.33 g/mol
LogP2.72
Rot. Bonds3

About hydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane

hydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane (PubChem CID 175195405) has the molecular formula C10H18F3OSi+ and a molecular weight of 239.33 g/mol. Its IUPAC name is hydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane.

Molecular Properties

Compound Namehydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane
PubChem CID175195405
Molecular FormulaC10H18F3OSi+
Molecular Weight239.33 g/mol
Exact Mass239.11
IUPAC Namehydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane
SMILESC[SiH2]C1(CC=CC(F)(F)F)CCCCO1.[H+]
InChIInChI=1S/C10H17F3OSi/c1-15-9(5-2-3-8-14-9)6-4-7-10(11,12)13/h4,7H,2-3,5-6,8,15H2,1H3/p+1
InChIKeySQTXVKQUELDNIB-UHFFFAOYSA-O
XLogP2.72
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.33
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane?
The IUPAC name of hydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane (CID 175195405) is hydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane.
What is the SMILES notation for hydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane?
The canonical SMILES for hydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane is C[SiH2]C1(CC=CC(F)(F)F)CCCCO1.[H+].
What is the InChIKey of hydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane?
The InChIKey is SQTXVKQUELDNIB-UHFFFAOYSA-O. The full InChI is InChI=1S/C10H17F3OSi/c1-15-9(5-2-3-8-14-9)6-4-7-10(11,12)13/h4,7H,2-3,5-6,8,15H2,1H3/p+1.
What are the key properties of hydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane?
hydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane has a molecular weight of 239.33 g/mol, XLogP of 2.72, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;methyl-[2-(4,4,4-trifluorobut-2-enyl)oxan-2-yl]silane is sourced from PubChem (CID 175195405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).