ethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane

C11H23F3O2Si — CID 87247852

IUPACethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane
SMILESCC[Si](CCC(F)(F)F)(OC(C)C)OC(C)C
InChIInChI=1S/C11H23F3O2Si/c1-6-17(15-9(2)3,16-10(4)5)8-7-11(12,13)14/h9-10H,6-8H2,1-5H3
InChIKeySXQHWZSAYKDJJL-UHFFFAOYSA-N
MW272.38 g/mol
LogP4.25
Rot. Bonds7

About ethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane

ethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane (PubChem CID 87247852) has the molecular formula C11H23F3O2Si and a molecular weight of 272.38 g/mol. Its IUPAC name is ethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane.

Molecular Properties

Compound Nameethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane
PubChem CID87247852
Molecular FormulaC11H23F3O2Si
Molecular Weight272.38 g/mol
Exact Mass272.14
IUPAC Nameethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane
SMILESCC[Si](CCC(F)(F)F)(OC(C)C)OC(C)C
InChIInChI=1S/C11H23F3O2Si/c1-6-17(15-9(2)3,16-10(4)5)8-7-11(12,13)14/h9-10H,6-8H2,1-5H3
InChIKeySXQHWZSAYKDJJL-UHFFFAOYSA-N
XLogP4.25
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.38
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 ethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane?
The IUPAC name of ethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane (CID 87247852) is ethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane.
What is the SMILES notation for ethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane?
The canonical SMILES for ethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane is CC[Si](CCC(F)(F)F)(OC(C)C)OC(C)C.
What is the InChIKey of ethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane?
The InChIKey is SXQHWZSAYKDJJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23F3O2Si/c1-6-17(15-9(2)3,16-10(4)5)8-7-11(12,13)14/h9-10H,6-8H2,1-5H3.
What are the key properties of ethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane?
ethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane has a molecular weight of 272.38 g/mol, XLogP of 4.25, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-di(propan-2-yloxy)-(3,3,3-trifluoropropyl)silane is sourced from PubChem (CID 87247852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).