6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane

C12H24F2OSi — CID 57151328

IUPAC6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane
SMILESC=CCC(CC(CC)C(F)F)O[Si](C)(C)C
InChIInChI=1S/C12H24F2OSi/c1-6-8-11(15-16(3,4)5)9-10(7-2)12(13)14/h6,10-12H,1,7-9H2,2-5H3
InChIKeySIMAEIOYDVHQOS-UHFFFAOYSA-N
MW250.40 g/mol
LogP4.46
Rot. Bonds8

About 6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane

6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane (PubChem CID 57151328) has the molecular formula C12H24F2OSi and a molecular weight of 250.40 g/mol. Its IUPAC name is 6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane.

Molecular Properties

Compound Name6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane
PubChem CID57151328
Molecular FormulaC12H24F2OSi
Molecular Weight250.40 g/mol
Exact Mass250.16
IUPAC Name6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane
SMILESC=CCC(CC(CC)C(F)F)O[Si](C)(C)C
InChIInChI=1S/C12H24F2OSi/c1-6-8-11(15-16(3,4)5)9-10(7-2)12(13)14/h6,10-12H,1,7-9H2,2-5H3
InChIKeySIMAEIOYDVHQOS-UHFFFAOYSA-N
XLogP4.46
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.40
LogP ≤ 54.46
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 6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane?
The IUPAC name of 6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane (CID 57151328) is 6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane.
What is the SMILES notation for 6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane?
The canonical SMILES for 6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane is C=CCC(CC(CC)C(F)F)O[Si](C)(C)C.
What is the InChIKey of 6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane?
The InChIKey is SIMAEIOYDVHQOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24F2OSi/c1-6-8-11(15-16(3,4)5)9-10(7-2)12(13)14/h6,10-12H,1,7-9H2,2-5H3.
What are the key properties of 6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane?
6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane has a molecular weight of 250.40 g/mol, XLogP of 4.46, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)oct-1-en-4-yloxy-trimethylsilane is sourced from PubChem (CID 57151328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).