trichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane

C13H26Cl3FOSi — CID 156769582

IUPACtrichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane
SMILESCCCCCCCCC(C)(F)OCCC[Si](Cl)(Cl)Cl
InChIInChI=1S/C13H26Cl3FOSi/c1-3-4-5-6-7-8-10-13(2,17)18-11-9-12-19(14,15)16/h3-12H2,1-2H3
InChIKeyGHPYBGHWPVWLGB-UHFFFAOYSA-N
MW351.79 g/mol
LogP6.48
Rot. Bonds12

About trichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane

trichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane (PubChem CID 156769582) has the molecular formula C13H26Cl3FOSi and a molecular weight of 351.79 g/mol. Its IUPAC name is trichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane.

Molecular Properties

Compound Nametrichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane
PubChem CID156769582
Molecular FormulaC13H26Cl3FOSi
Molecular Weight351.79 g/mol
Exact Mass350.08
IUPAC Nametrichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane
SMILESCCCCCCCCC(C)(F)OCCC[Si](Cl)(Cl)Cl
InChIInChI=1S/C13H26Cl3FOSi/c1-3-4-5-6-7-8-10-13(2,17)18-11-9-12-19(14,15)16/h3-12H2,1-2H3
InChIKeyGHPYBGHWPVWLGB-UHFFFAOYSA-N
XLogP6.48
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.79
LogP ≤ 56.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

trichloro(octyl)silane
CID 21354
9-heptoxy-9-methylhenicosane
CID 91127088
ethoxysilane;trichloro(octadecyl)silane
CID 158053635
chlorosilane;trichloro(tetradecyl)silane
CID 159383155
16-(10-fluorodecoxy)-16-methylhentriacontane
CID 139714709
2-dodecoxy-2-methyltetradecane
CID 158074564
trichloro(octadecyl)silane;trimethoxy(octadecyl)silane
CID 174467705
10-decoxy-10-nonylnonadecane
CID 150430521
trichloro(3-chloropropyl)silane;trichloro(octyl)silane
CID 87989801
trichloro(octadecyl)silane;trimethoxy(methyl)silane
CID 174224724
trichloro(1,1,2,2-tetrafluorooctyl)silane
CID 102098431
9-fluoropentacosan-9-ol
CID 139794548

Frequently Asked Questions

What is the IUPAC name of trichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane?
The IUPAC name of trichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane (CID 156769582) is trichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane.
What is the SMILES notation for trichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane?
The canonical SMILES for trichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane is CCCCCCCCC(C)(F)OCCC[Si](Cl)(Cl)Cl.
What is the InChIKey of trichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane?
The InChIKey is GHPYBGHWPVWLGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26Cl3FOSi/c1-3-4-5-6-7-8-10-13(2,17)18-11-9-12-19(14,15)16/h3-12H2,1-2H3.
What are the key properties of trichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane?
trichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane has a molecular weight of 351.79 g/mol, XLogP of 6.48, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro-[3-(2-fluorodecan-2-yloxy)propyl]silane is sourced from PubChem (CID 156769582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).