6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane

C10H15F7OSi — CID 87787785

IUPAC6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane
SMILESCC1(C(F)(F)C(F)(F)C(F)(F)F)CCC[Si](C)(C)O1
InChIInChI=1S/C10H15F7OSi/c1-7(5-4-6-19(2,3)18-7)8(11,12)9(13,14)10(15,16)17/h4-6H2,1-3H3
InChIKeyLHNMOTZVCYDFLK-UHFFFAOYSA-N
MW312.30 g/mol
LogP4.59
Rot. Bonds2

About 6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane

6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane (PubChem CID 87787785) has the molecular formula C10H15F7OSi and a molecular weight of 312.30 g/mol. Its IUPAC name is 6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane.

Molecular Properties

Compound Name6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane
PubChem CID87787785
Molecular FormulaC10H15F7OSi
Molecular Weight312.30 g/mol
Exact Mass312.08
IUPAC Name6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane
SMILESCC1(C(F)(F)C(F)(F)C(F)(F)F)CCC[Si](C)(C)O1
InChIInChI=1S/C10H15F7OSi/c1-7(5-4-6-19(2,3)18-7)8(11,12)9(13,14)10(15,16)17/h4-6H2,1-3H3
InChIKeyLHNMOTZVCYDFLK-UHFFFAOYSA-N
XLogP4.59
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.30
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 69887081
CID 69887081
CID 87142556
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CID 87257406
CID 87257406
CID 87728885
CID 87728885
CID 89814271
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CID 147446809
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CID 173552981
CID 173552981

Frequently Asked Questions

What is the IUPAC name of 6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane?
The IUPAC name of 6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane (CID 87787785) is 6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane.
What is the SMILES notation for 6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane?
The canonical SMILES for 6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane is CC1(C(F)(F)C(F)(F)C(F)(F)F)CCC[Si](C)(C)O1.
What is the InChIKey of 6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane?
The InChIKey is LHNMOTZVCYDFLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F7OSi/c1-7(5-4-6-19(2,3)18-7)8(11,12)9(13,14)10(15,16)17/h4-6H2,1-3H3.
What are the key properties of 6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane?
6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane has a molecular weight of 312.30 g/mol, XLogP of 4.59, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1,1,2,2,3,3,3-heptafluoropropyl)-2,2,6-trimethyloxasilinane is sourced from PubChem (CID 87787785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).