2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane

C10H17F3OSi — CID 19922168

IUPAC2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane
SMILESC=CC[Si]1(CCC(F)(F)F)CCCCO1
InChIInChI=1S/C10H17F3OSi/c1-2-7-15(8-4-3-6-14-15)9-5-10(11,12)13/h2H,1,3-9H2
InChIKeyCFQBGHFCTOAIEC-UHFFFAOYSA-N
MW238.32 g/mol
LogP3.88
Rot. Bonds4

About 2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane

2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane (PubChem CID 19922168) has the molecular formula C10H17F3OSi and a molecular weight of 238.32 g/mol. Its IUPAC name is 2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane.

Molecular Properties

Compound Name2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane
PubChem CID19922168
Molecular FormulaC10H17F3OSi
Molecular Weight238.32 g/mol
Exact Mass238.10
IUPAC Name2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane
SMILESC=CC[Si]1(CCC(F)(F)F)CCCCO1
InChIInChI=1S/C10H17F3OSi/c1-2-7-15(8-4-3-6-14-15)9-5-10(11,12)13/h2H,1,3-9H2
InChIKeyCFQBGHFCTOAIEC-UHFFFAOYSA-N
XLogP3.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.32
LogP ≤ 53.88
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 2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane?
The IUPAC name of 2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane (CID 19922168) is 2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane.
What is the SMILES notation for 2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane?
The canonical SMILES for 2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane is C=CC[Si]1(CCC(F)(F)F)CCCCO1.
What is the InChIKey of 2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane?
The InChIKey is CFQBGHFCTOAIEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3OSi/c1-2-7-15(8-4-3-6-14-15)9-5-10(11,12)13/h2H,1,3-9H2.
What are the key properties of 2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane?
2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane has a molecular weight of 238.32 g/mol, XLogP of 3.88, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enyl-2-(3,3,3-trifluoropropyl)oxasilinane is sourced from PubChem (CID 19922168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).