3-fluorodecan-2-yl(trimethoxy)silane

C13H29FO3Si — CID 87402948

IUPAC3-fluorodecan-2-yl(trimethoxy)silane
SMILESCCCCCCCC(F)C(C)[Si](OC)(OC)OC
InChIInChI=1S/C13H29FO3Si/c1-6-7-8-9-10-11-13(14)12(2)18(15-3,16-4)17-5/h12-13H,6-11H2,1-5H3
InChIKeyZQWLBSFHNIIGLK-UHFFFAOYSA-N
MW280.46 g/mol
LogP3.95
Rot. Bonds11

About 3-fluorodecan-2-yl(trimethoxy)silane

3-fluorodecan-2-yl(trimethoxy)silane (PubChem CID 87402948) has the molecular formula C13H29FO3Si and a molecular weight of 280.46 g/mol. Its IUPAC name is 3-fluorodecan-2-yl(trimethoxy)silane.

Molecular Properties

Compound Name3-fluorodecan-2-yl(trimethoxy)silane
PubChem CID87402948
Molecular FormulaC13H29FO3Si
Molecular Weight280.46 g/mol
Exact Mass280.19
IUPAC Name3-fluorodecan-2-yl(trimethoxy)silane
SMILESCCCCCCCC(F)C(C)[Si](OC)(OC)OC
InChIInChI=1S/C13H29FO3Si/c1-6-7-8-9-10-11-13(14)12(2)18(15-3,16-4)17-5/h12-13H,6-11H2,1-5H3
InChIKeyZQWLBSFHNIIGLK-UHFFFAOYSA-N
XLogP3.95
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 53.95
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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Related Compounds

1,3-difluoro-2-methyloctane
CID 134441598
1-trimethoxysilyloctan-1-amine
CID 87463125
2-fluorohenicosane
CID 91354486
(2R,3S,4R)-2,3,4-trifluorononane
CID 102212838
3-trimethoxysilyltetradecan-1-amine
CID 22997270
4-ethylnonadecan-3-yl(trimethoxy)silane
CID 88743379
trimethoxy(1-trimethoxysilyloctan-2-yl)silane
CID 154069020
4-fluoro-3-methyloctane
CID 89416555
trimethoxy-[1-(1-trimethoxysilyldodecylheptasulfanyl)dodecyl]silane
CID 54212897
trimethoxy(4-methylicosyl)silane
CID 88743380
3-fluoro-2-propan-2-ylundecan-1-amine
CID 107443718
8-trimethoxysilylhenicosan-11-amine;hydrochloride
CID 173245957

Frequently Asked Questions

What is the IUPAC name of 3-fluorodecan-2-yl(trimethoxy)silane?
The IUPAC name of 3-fluorodecan-2-yl(trimethoxy)silane (CID 87402948) is 3-fluorodecan-2-yl(trimethoxy)silane.
What is the SMILES notation for 3-fluorodecan-2-yl(trimethoxy)silane?
The canonical SMILES for 3-fluorodecan-2-yl(trimethoxy)silane is CCCCCCCC(F)C(C)[Si](OC)(OC)OC.
What is the InChIKey of 3-fluorodecan-2-yl(trimethoxy)silane?
The InChIKey is ZQWLBSFHNIIGLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29FO3Si/c1-6-7-8-9-10-11-13(14)12(2)18(15-3,16-4)17-5/h12-13H,6-11H2,1-5H3.
What are the key properties of 3-fluorodecan-2-yl(trimethoxy)silane?
3-fluorodecan-2-yl(trimethoxy)silane has a molecular weight of 280.46 g/mol, XLogP of 3.95, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluorodecan-2-yl(trimethoxy)silane is sourced from PubChem (CID 87402948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).