diethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane

C30H63FO3Si — CID 175547717

IUPACdiethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane
SMILESCCCCCCCCCC(C)CCCC(C)O[Si](CCCCCCCCCCF)(OCC)OCC
InChIInChI=1S/C30H63FO3Si/c1-6-9-10-11-14-17-20-24-29(4)25-23-26-30(5)34-35(32-7-2,33-8-3)28-22-19-16-13-12-15-18-21-27-31/h29-30H,6-28H2,1-5H3
InChIKeyMWIVGKKXUCVRRJ-UHFFFAOYSA-N
MW518.92 g/mol
LogP10.44
Rot. Bonds28

About diethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane

diethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane (PubChem CID 175547717) has the molecular formula C30H63FO3Si and a molecular weight of 518.92 g/mol. Its IUPAC name is diethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane.

Molecular Properties

Compound Namediethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane
PubChem CID175547717
Molecular FormulaC30H63FO3Si
Molecular Weight518.92 g/mol
Exact Mass518.45
IUPAC Namediethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane
SMILESCCCCCCCCCC(C)CCCC(C)O[Si](CCCCCCCCCCF)(OCC)OCC
InChIInChI=1S/C30H63FO3Si/c1-6-9-10-11-14-17-20-24-29(4)25-23-26-30(5)34-35(32-7-2,33-8-3)28-22-19-16-13-12-15-18-21-27-31/h29-30H,6-28H2,1-5H3
InChIKeyMWIVGKKXUCVRRJ-UHFFFAOYSA-N
XLogP10.44
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds28
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500518.92
LogP ≤ 510.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of diethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane?
The IUPAC name of diethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane (CID 175547717) is diethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane.
What is the SMILES notation for diethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane?
The canonical SMILES for diethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane is CCCCCCCCCC(C)CCCC(C)O[Si](CCCCCCCCCCF)(OCC)OCC.
What is the InChIKey of diethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane?
The InChIKey is MWIVGKKXUCVRRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H63FO3Si/c1-6-9-10-11-14-17-20-24-29(4)25-23-26-30(5)34-35(32-7-2,33-8-3)28-22-19-16-13-12-15-18-21-27-31/h29-30H,6-28H2,1-5H3.
What are the key properties of diethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane?
diethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane has a molecular weight of 518.92 g/mol, XLogP of 10.44, 28 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane is sourced from PubChem (CID 175547717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).