[2-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane

C17H31F3O2Si2 — CID 174848083

IUPAC[2-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane
SMILESFC(F)(F)CCC(=CCC1([SiH3])CCCCO1)CC1([SiH3])CCCCO1
InChIInChI=1S/C17H31F3O2Si2/c18-17(19,20)10-6-14(13-16(24)8-2-4-12-22-16)5-9-15(23)7-1-3-11-21-15/h5H,1-4,6-13H2,23-24H3
InChIKeyRTSDCEZIDUHBBO-UHFFFAOYSA-N
MW380.60 g/mol
LogP2.56
Rot. Bonds6

About [2-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane

[2-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane (PubChem CID 174848083) has the molecular formula C17H31F3O2Si2 and a molecular weight of 380.60 g/mol. Its IUPAC name is [2-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane.

Molecular Properties

Compound Name[2-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane
PubChem CID174848083
Molecular FormulaC17H31F3O2Si2
Molecular Weight380.60 g/mol
Exact Mass380.18
IUPAC Name[2-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane
SMILESFC(F)(F)CCC(=CCC1([SiH3])CCCCO1)CC1([SiH3])CCCCO1
InChIInChI=1S/C17H31F3O2Si2/c18-17(19,20)10-6-14(13-16(24)8-2-4-12-22-16)5-9-15(23)7-1-3-11-21-15/h5H,1-4,6-13H2,23-24H3
InChIKeyRTSDCEZIDUHBBO-UHFFFAOYSA-N
XLogP2.56
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.60
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane?
The IUPAC name of [2-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane (CID 174848083) is [2-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane.
What is the SMILES notation for [2-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane?
The canonical SMILES for [2-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane is FC(F)(F)CCC(=CCC1([SiH3])CCCCO1)CC1([SiH3])CCCCO1.
What is the InChIKey of [2-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane?
The InChIKey is RTSDCEZIDUHBBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31F3O2Si2/c18-17(19,20)10-6-14(13-16(24)8-2-4-12-22-16)5-9-15(23)7-1-3-11-21-15/h5H,1-4,6-13H2,23-24H3.
What are the key properties of [2-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane?
[2-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane has a molecular weight of 380.60 g/mol, XLogP of 2.56, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[5,5,5-trifluoro-2-[2-(2-silyloxan-2-yl)ethylidene]pentyl]oxan-2-yl]silane is sourced from PubChem (CID 174848083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).