(3,5-difluorophenoxy)-tripropylsilane

C15H24F2OSi — CID 530803

IUPAC(3,5-difluorophenoxy)-tripropylsilane
SMILESCCC[Si](CCC)(CCC)Oc1cc(F)cc(F)c1
InChIInChI=1S/C15H24F2OSi/c1-4-7-19(8-5-2,9-6-3)18-15-11-13(16)10-14(17)12-15/h10-12H,4-9H2,1-3H3
InChIKeyCETBUVYKDWOJCM-UHFFFAOYSA-N
MW286.44 g/mol
LogP5.52
Rot. Bonds8

About (3,5-difluorophenoxy)-tripropylsilane

(3,5-difluorophenoxy)-tripropylsilane (PubChem CID 530803) has the molecular formula C15H24F2OSi and a molecular weight of 286.44 g/mol. Its IUPAC name is (3,5-difluorophenoxy)-tripropylsilane.

Molecular Properties

Compound Name(3,5-difluorophenoxy)-tripropylsilane
PubChem CID530803
Molecular FormulaC15H24F2OSi
Molecular Weight286.44 g/mol
Exact Mass286.16
IUPAC Name(3,5-difluorophenoxy)-tripropylsilane
SMILESCCC[Si](CCC)(CCC)Oc1cc(F)cc(F)c1
InChIInChI=1S/C15H24F2OSi/c1-4-7-19(8-5-2,9-6-3)18-15-11-13(16)10-14(17)12-15/h10-12H,4-9H2,1-3H3
InChIKeyCETBUVYKDWOJCM-UHFFFAOYSA-N
XLogP5.52
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.44
LogP ≤ 55.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3,5-difluorophenoxy)-tripropylsilane?
The IUPAC name of (3,5-difluorophenoxy)-tripropylsilane (CID 530803) is (3,5-difluorophenoxy)-tripropylsilane.
What is the SMILES notation for (3,5-difluorophenoxy)-tripropylsilane?
The canonical SMILES for (3,5-difluorophenoxy)-tripropylsilane is CCC[Si](CCC)(CCC)Oc1cc(F)cc(F)c1.
What is the InChIKey of (3,5-difluorophenoxy)-tripropylsilane?
The InChIKey is CETBUVYKDWOJCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24F2OSi/c1-4-7-19(8-5-2,9-6-3)18-15-11-13(16)10-14(17)12-15/h10-12H,4-9H2,1-3H3.
What are the key properties of (3,5-difluorophenoxy)-tripropylsilane?
(3,5-difluorophenoxy)-tripropylsilane has a molecular weight of 286.44 g/mol, XLogP of 5.52, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-difluorophenoxy)-tripropylsilane is sourced from PubChem (CID 530803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).