trifluoro(octadecan-2-yl)silane

C18H37F3Si — CID 58559863

IUPACtrifluoro(octadecan-2-yl)silane
SMILESCCCCCCCCCCCCCCCCC(C)[Si](F)(F)F
InChIInChI=1S/C18H37F3Si/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2)22(19,20)21/h18H,3-17H2,1-2H3
InChIKeyHVEBUAGCRLDUPU-UHFFFAOYSA-N
MW338.57 g/mol
LogP8.10
Rot. Bonds16

About trifluoro(octadecan-2-yl)silane

trifluoro(octadecan-2-yl)silane (PubChem CID 58559863) has the molecular formula C18H37F3Si and a molecular weight of 338.57 g/mol. Its IUPAC name is trifluoro(octadecan-2-yl)silane.

Molecular Properties

Compound Nametrifluoro(octadecan-2-yl)silane
PubChem CID58559863
Molecular FormulaC18H37F3Si
Molecular Weight338.57 g/mol
Exact Mass338.26
IUPAC Nametrifluoro(octadecan-2-yl)silane
SMILESCCCCCCCCCCCCCCCCC(C)[Si](F)(F)F
InChIInChI=1S/C18H37F3Si/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2)22(19,20)21/h18H,3-17H2,1-2H3
InChIKeyHVEBUAGCRLDUPU-UHFFFAOYSA-N
XLogP8.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds16
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.57
LogP ≤ 58.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

dodecan-2-yl(trimethyl)silane
CID 11425039
chloro-dimethyl-nonan-2-ylsilane
CID 101114089
2-fluorohenicosane
CID 91354486
N-fluorooctan-2-amine
CID 88597566
6-methyloctacosane
CID 22223942
11,12-dimethyltricosane
CID 173430605
(7R)-7-methyltricosane
CID 162971691
27-methyltripentacontane
CID 91450521
8,13-dimethyloctacosane
CID 71323274
6-methylheptacosane
CID 22223776
2-methylpentaoctacontane
CID 90745672
16,17-dimethyltritriacontane
CID 91506561

Frequently Asked Questions

What is the IUPAC name of trifluoro(octadecan-2-yl)silane?
The IUPAC name of trifluoro(octadecan-2-yl)silane (CID 58559863) is trifluoro(octadecan-2-yl)silane.
What is the SMILES notation for trifluoro(octadecan-2-yl)silane?
The canonical SMILES for trifluoro(octadecan-2-yl)silane is CCCCCCCCCCCCCCCCC(C)[Si](F)(F)F.
What is the InChIKey of trifluoro(octadecan-2-yl)silane?
The InChIKey is HVEBUAGCRLDUPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37F3Si/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2)22(19,20)21/h18H,3-17H2,1-2H3.
What are the key properties of trifluoro(octadecan-2-yl)silane?
trifluoro(octadecan-2-yl)silane has a molecular weight of 338.57 g/mol, XLogP of 8.10, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trifluoro(octadecan-2-yl)silane is sourced from PubChem (CID 58559863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).