CID 90171486

C10H14FO3Si — CID 90171486

IUPAC—
SMILESCO[Si](OC)OCCc1cccc(F)c1
InChIInChI=1S/C10H14FO3Si/c1-12-15(13-2)14-7-6-9-4-3-5-10(11)8-9/h3-5,8H,6-7H2,1-2H3
InChIKeyICNUYOWCADJFGV-UHFFFAOYSA-N
MW229.30 g/mol
LogP1.66
Rot. Bonds6

About CID 90171486

CID 90171486 (PubChem CID 90171486) has the molecular formula C10H14FO3Si and a molecular weight of 229.30 g/mol.

Molecular Properties

Compound NameCID 90171486
PubChem CID90171486
Molecular FormulaC10H14FO3Si
Molecular Weight229.30 g/mol
Exact Mass229.07
IUPAC Name—
SMILESCO[Si](OC)OCCc1cccc(F)c1
InChIInChI=1S/C10H14FO3Si/c1-12-15(13-2)14-7-6-9-4-3-5-10(11)8-9/h3-5,8H,6-7H2,1-2H3
InChIKeyICNUYOWCADJFGV-UHFFFAOYSA-N
XLogP1.66
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 51.66
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

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3-[2-(3-fluorophenyl)ethoxy]propanoic acid
CID 59296248
1,3-dichloro-2-[2-(3-fluorophenyl)ethoxy]benzene
CID 140972707
N-[[di(propan-2-yl)amino]-[2-(3-fluorophenyl)ethoxy]phosphanyl]-N-propan-2-ylpropan-2-amine
CID 155410293
6-(3-fluorophenyl)hexyl-hydroxy-dimethoxysilane
CID 90174154
1-(2-ethoxyethoxymethyl)-3-fluorobenzene
CID 173202169
N-[2-(3-fluorophenyl)ethyl]-3-methylbut-2-enamide
CID 127125179
acetylene;1-butyl-3-fluorobenzene
CID 142913636
1-(2,2-dimethoxyethyl)-3-[2-(3-fluorophenyl)ethyl]urea
CID 108901254
3-(3-fluorophenyl)-N-[(2S)-1-methoxypropan-2-yl]propanamide
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Frequently Asked Questions

What is the IUPAC name of CID 90171486?
The IUPAC name of CID 90171486 (CID 90171486) is not available.
What is the SMILES notation for CID 90171486?
The canonical SMILES for CID 90171486 is CO[Si](OC)OCCc1cccc(F)c1.
What is the InChIKey of CID 90171486?
The InChIKey is ICNUYOWCADJFGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FO3Si/c1-12-15(13-2)14-7-6-9-4-3-5-10(11)8-9/h3-5,8H,6-7H2,1-2H3.
What are the key properties of CID 90171486?
CID 90171486 has a molecular weight of 229.30 g/mol, XLogP of 1.66, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 90171486 is sourced from PubChem (CID 90171486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).