3-Fluorophenol, diisopropylsilyl ether

C12H18FOSi — CID 91722313

IUPAC—
SMILESCC(C)[Si](Oc1cccc(F)c1)C(C)C
InChIInChI=1S/C12H18FOSi/c1-9(2)15(10(3)4)14-12-7-5-6-11(13)8-12/h5-10H,1-4H3
InChIKeyWMIMGOANDDLLKD-UHFFFAOYSA-N
MW225.36 g/mol
LogP4.02
Rot. Bonds4

About 3-Fluorophenol, diisopropylsilyl ether

3-Fluorophenol, diisopropylsilyl ether (PubChem CID 91722313) has the molecular formula C12H18FOSi and a molecular weight of 225.36 g/mol.

Molecular Properties

Compound Name3-Fluorophenol, diisopropylsilyl ether
PubChem CID91722313
Molecular FormulaC12H18FOSi
Molecular Weight225.36 g/mol
Exact Mass225.11
IUPAC Name—
SMILESCC(C)[Si](Oc1cccc(F)c1)C(C)C
InChIInChI=1S/C12H18FOSi/c1-9(2)15(10(3)4)14-12-7-5-6-11(13)8-12/h5-10H,1-4H3
InChIKeyWMIMGOANDDLLKD-UHFFFAOYSA-N
XLogP4.02
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-(3-fluorophenoxy)propanoyl chloride
CID 139218096
N-(3-fluorophenoxy)methanamine
CID 117126743
1,4-bis[3-(3-fluorophenoxy)phenoxy]benzene
CID 22338391
O-(3-fluorophenyl)hydroxylamine;propane
CID 23134075
1-(3-fluorophenoxy)-N-propan-2-ylpropan-2-amine
CID 115905482
1-(3-fluorophenoxy)propan-2-ylhydrazine
CID 82280988
1-(3-fluorophenoxy)-3-methylbutan-2-amine;hydrochloride
CID 86262538
1-fluoro-3-(3-fluorophenoxy)-5-methylbenzene
CID 54548242
1-chloro-3-(3-fluorophenoxy)butan-2-one
CID 82040238
1-[2-fluoro-6-(3-fluorophenoxy)phenyl]ethanamine
CID 43189230
1-[2-(bromomethyl)-3-methylbutoxy]-3-fluorobenzene
CID 65012281
(3-fluorophenoxy)-propan-2-ylcarbamic acid
CID 87543419

Frequently Asked Questions

What is the IUPAC name of 3-Fluorophenol, diisopropylsilyl ether?
The IUPAC name of 3-Fluorophenol, diisopropylsilyl ether (CID 91722313) is not available.
What is the SMILES notation for 3-Fluorophenol, diisopropylsilyl ether?
The canonical SMILES for 3-Fluorophenol, diisopropylsilyl ether is CC(C)[Si](Oc1cccc(F)c1)C(C)C.
What is the InChIKey of 3-Fluorophenol, diisopropylsilyl ether?
The InChIKey is WMIMGOANDDLLKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18FOSi/c1-9(2)15(10(3)4)14-12-7-5-6-11(13)8-12/h5-10H,1-4H3.
What are the key properties of 3-Fluorophenol, diisopropylsilyl ether?
3-Fluorophenol, diisopropylsilyl ether has a molecular weight of 225.36 g/mol, XLogP of 4.02, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-Fluorophenol, diisopropylsilyl ether is sourced from PubChem (CID 91722313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).