triethoxy-(2-fluorophenyl)silane

C12H19FO3Si — CID 139239787

IUPACtriethoxy-(2-fluorophenyl)silane
SMILESCCO[Si](OCC)(OCC)c1ccccc1F
InChIInChI=1S/C12H19FO3Si/c1-4-14-17(15-5-2,16-6-3)12-10-8-7-9-11(12)13/h7-10H,4-6H2,1-3H3
InChIKeyUYAIGSQWKQZWCJ-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.08
Rot. Bonds7

About triethoxy-(2-fluorophenyl)silane

triethoxy-(2-fluorophenyl)silane (PubChem CID 139239787) has the molecular formula C12H19FO3Si and a molecular weight of 258.36 g/mol. Its IUPAC name is triethoxy-(2-fluorophenyl)silane.

Molecular Properties

Compound Nametriethoxy-(2-fluorophenyl)silane
PubChem CID139239787
Molecular FormulaC12H19FO3Si
Molecular Weight258.36 g/mol
Exact Mass258.11
IUPAC Nametriethoxy-(2-fluorophenyl)silane
SMILESCCO[Si](OCC)(OCC)c1ccccc1F
InChIInChI=1S/C12H19FO3Si/c1-4-14-17(15-5-2,16-6-3)12-10-8-7-9-11(12)13/h7-10H,4-6H2,1-3H3
InChIKeyUYAIGSQWKQZWCJ-UHFFFAOYSA-N
XLogP2.08
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.08
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

N,N-dimethyl-1-(2-triethoxysilylphenyl)methanamine
CID 71411551
1-(2-triethoxysilylphenyl)ethanone
CID 175456342
anthracen-1-yl(triethoxy)silane
CID 87178396
fluorosilane;triethoxy(phenyl)silane
CID 174494490
triethoxy-[(2-fluorophenyl)methyl]silane
CID 146004998
ethane;triethoxy(phenyl)silane
CID 174836592
triethoxy-[(1S)-1-(2-fluorophenyl)ethyl]silane
CID 10108079
(2,6-difluorophenyl)methyl-triethoxysilane
CID 146004962
silane;triethoxy(phenyl)silane;hydrofluoride
CID 174494492
[diethoxy(phenyl)silyl]oxy-diethoxy-phenylsilane
CID 14533277
triethoxy-(5-triethoxysilylthiophen-2-yl)silane
CID 15466978
triethoxy-[4-(4-phenylphenyl)phenyl]silane
CID 59687607

Frequently Asked Questions

What is the IUPAC name of triethoxy-(2-fluorophenyl)silane?
The IUPAC name of triethoxy-(2-fluorophenyl)silane (CID 139239787) is triethoxy-(2-fluorophenyl)silane.
What is the SMILES notation for triethoxy-(2-fluorophenyl)silane?
The canonical SMILES for triethoxy-(2-fluorophenyl)silane is CCO[Si](OCC)(OCC)c1ccccc1F.
What is the InChIKey of triethoxy-(2-fluorophenyl)silane?
The InChIKey is UYAIGSQWKQZWCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19FO3Si/c1-4-14-17(15-5-2,16-6-3)12-10-8-7-9-11(12)13/h7-10H,4-6H2,1-3H3.
What are the key properties of triethoxy-(2-fluorophenyl)silane?
triethoxy-(2-fluorophenyl)silane has a molecular weight of 258.36 g/mol, XLogP of 2.08, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-(2-fluorophenyl)silane is sourced from PubChem (CID 139239787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).