3-fluoro-1,1,2-trimethoxy-2-propylsilinane

C11H23FO3Si — CID 174485939

IUPAC3-fluoro-1,1,2-trimethoxy-2-propylsilinane
SMILESCCCC1(OC)C(F)CCC[Si]1(OC)OC
InChIInChI=1S/C11H23FO3Si/c1-5-8-11(13-2)10(12)7-6-9-16(11,14-3)15-4/h10H,5-9H2,1-4H3
InChIKeyZIYWJGMOWNNMMW-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.58
Rot. Bonds5

About 3-fluoro-1,1,2-trimethoxy-2-propylsilinane

3-fluoro-1,1,2-trimethoxy-2-propylsilinane (PubChem CID 174485939) has the molecular formula C11H23FO3Si and a molecular weight of 250.39 g/mol. Its IUPAC name is 3-fluoro-1,1,2-trimethoxy-2-propylsilinane.

Molecular Properties

Compound Name3-fluoro-1,1,2-trimethoxy-2-propylsilinane
PubChem CID174485939
Molecular FormulaC11H23FO3Si
Molecular Weight250.39 g/mol
Exact Mass250.14
IUPAC Name3-fluoro-1,1,2-trimethoxy-2-propylsilinane
SMILESCCCC1(OC)C(F)CCC[Si]1(OC)OC
InChIInChI=1S/C11H23FO3Si/c1-5-8-11(13-2)10(12)7-6-9-16(11,14-3)15-4/h10H,5-9H2,1-4H3
InChIKeyZIYWJGMOWNNMMW-UHFFFAOYSA-N
XLogP2.58
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-chloro-1,1,2-trimethoxy-2-propylsilinane
CID 174351373
1,1,2-trimethoxy-3-[(2-methylpropan-2-yl)oxy]-2-propylsilinane
CID 174791973
3-(1,1,2-trimethoxy-2-propylsilinan-3-yl)oxetane
CID 174604447
1-(1,1,2-trimethoxy-2-propylsilinan-3-yl)pyrrole
CID 174594008
3-(3,5-difluorophenyl)-1,1,2-trimethoxy-2-propylsilinane
CID 174718664
3-methyloxetane;1,1,2,3-tetramethoxy-2-propylsilinane
CID 174747798
1,1,2-trimethoxy-N,N-dioctyl-2-propylsilinan-3-amine
CID 174751630
(1,1,2-trimethoxy-2-propylsilinan-3-yl) but-2-enoate
CID 174267912
2-[1-(1,1,2-trimethoxy-2-propylsilinan-3-yl)propoxymethyl]oxirane
CID 174280958
3-ethyl-3-[(1,1,2-trimethoxy-2-propylsilinan-3-yl)oxymethoxymethyl]oxetane
CID 174779788
3-(3-ethyl-1,1,2-trimethoxysilinan-2-yl)propan-1-amine
CID 174818677
N-(3-phenylprop-2-enyl)-N'-(1,1,2-trimethoxy-2-propylsilinan-3-yl)ethane-1,2-diamine
CID 174750677

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-1,1,2-trimethoxy-2-propylsilinane?
The IUPAC name of 3-fluoro-1,1,2-trimethoxy-2-propylsilinane (CID 174485939) is 3-fluoro-1,1,2-trimethoxy-2-propylsilinane.
What is the SMILES notation for 3-fluoro-1,1,2-trimethoxy-2-propylsilinane?
The canonical SMILES for 3-fluoro-1,1,2-trimethoxy-2-propylsilinane is CCCC1(OC)C(F)CCC[Si]1(OC)OC.
What is the InChIKey of 3-fluoro-1,1,2-trimethoxy-2-propylsilinane?
The InChIKey is ZIYWJGMOWNNMMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23FO3Si/c1-5-8-11(13-2)10(12)7-6-9-16(11,14-3)15-4/h10H,5-9H2,1-4H3.
What are the key properties of 3-fluoro-1,1,2-trimethoxy-2-propylsilinane?
3-fluoro-1,1,2-trimethoxy-2-propylsilinane has a molecular weight of 250.39 g/mol, XLogP of 2.58, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-1,1,2-trimethoxy-2-propylsilinane is sourced from PubChem (CID 174485939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).