2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane

C11H19F3OSi — CID 22444649

IUPAC2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane
SMILESC=C(C)C1CCC[Si](C)(CCC(F)(F)F)O1
InChIInChI=1S/C11H19F3OSi/c1-9(2)10-5-4-7-16(3,15-10)8-6-11(12,13)14/h10H,1,4-8H2,2-3H3
InChIKeyBYVDJAUDSHUIOQ-UHFFFAOYSA-N
MW252.35 g/mol
LogP4.27
Rot. Bonds3

About 2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane

2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane (PubChem CID 22444649) has the molecular formula C11H19F3OSi and a molecular weight of 252.35 g/mol. Its IUPAC name is 2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane.

Molecular Properties

Compound Name2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane
PubChem CID22444649
Molecular FormulaC11H19F3OSi
Molecular Weight252.35 g/mol
Exact Mass252.12
IUPAC Name2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane
SMILESC=C(C)C1CCC[Si](C)(CCC(F)(F)F)O1
InChIInChI=1S/C11H19F3OSi/c1-9(2)10-5-4-7-16(3,15-10)8-6-11(12,13)14/h10H,1,4-8H2,2-3H3
InChIKeyBYVDJAUDSHUIOQ-UHFFFAOYSA-N
XLogP4.27
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.35
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': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane?
The IUPAC name of 2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane (CID 22444649) is 2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane.
What is the SMILES notation for 2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane?
The canonical SMILES for 2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane is C=C(C)C1CCC[Si](C)(CCC(F)(F)F)O1.
What is the InChIKey of 2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane?
The InChIKey is BYVDJAUDSHUIOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3OSi/c1-9(2)10-5-4-7-16(3,15-10)8-6-11(12,13)14/h10H,1,4-8H2,2-3H3.
What are the key properties of 2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane?
2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane has a molecular weight of 252.35 g/mol, XLogP of 4.27, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-prop-1-en-2-yl-2-(3,3,3-trifluoropropyl)oxasilinane is sourced from PubChem (CID 22444649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).