triethyl [(1S)-1-phenylethyl] silicate

C14H24O4Si — CID 102403172

IUPACtriethyl [(1S)-1-phenylethyl] silicate
SMILESCCO[Si](OCC)(OCC)O[C@@H](C)c1ccccc1
InChIInChI=1S/C14H24O4Si/c1-5-15-19(16-6-2,17-7-3)18-13(4)14-11-9-8-10-12-14/h8-13H,5-7H2,1-4H3/t13-/m0/s1
InChIKeyWYUOOWKMPZFRKO-ZDUSSCGKSA-N
MW284.43 g/mol
LogP3.31
Rot. Bonds9

About triethyl [(1S)-1-phenylethyl] silicate

triethyl [(1S)-1-phenylethyl] silicate (PubChem CID 102403172) has the molecular formula C14H24O4Si and a molecular weight of 284.43 g/mol. Its IUPAC name is triethyl [(1S)-1-phenylethyl] silicate.

Molecular Properties

Compound Nametriethyl [(1S)-1-phenylethyl] silicate
PubChem CID102403172
Molecular FormulaC14H24O4Si
Molecular Weight284.43 g/mol
Exact Mass284.14
IUPAC Nametriethyl [(1S)-1-phenylethyl] silicate
SMILESCCO[Si](OCC)(OCC)O[C@@H](C)c1ccccc1
InChIInChI=1S/C14H24O4Si/c1-5-15-19(16-6-2,17-7-3)18-13(4)14-11-9-8-10-12-14/h8-13H,5-7H2,1-4H3/t13-/m0/s1
InChIKeyWYUOOWKMPZFRKO-ZDUSSCGKSA-N
XLogP3.31
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.43
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

diphenyl-bis(1-phenylethoxy)silane
CID 68535172
trimethyl(1-phenylethoxy)silane
CID 519015
1-cyclohexyl-3-[diethoxy(1-phenylethoxy)silyl]propan-1-amine
CID 70117720
[[ethoxy-[(2-methylpropan-2-yl)oxy]phosphoryl]-phenylmethyl] triethyl silicate
CID 622884
benzyl triethyl silicate
CID 14245028
[diethoxy(methyl)silyl]-phenylmethanol
CID 140892861
2-phenyl-2-triethoxysilylethanamine
CID 174861845
phenyl-tri(propan-2-yloxy)silane;triethoxy(phenyl)silane
CID 159737253
benzyl(triethoxy)silane;propan-2-ol
CID 172724025
1-[diethoxy(phenyl)silyl]ethyl-diethoxy-phenylsilane
CID 54185163
2-ethoxy-N-[2-(1-phenylethoxy)ethyl]ethanamine
CID 62566170
diethyl [(1S)-1-phenylethyl] phosphate
CID 10945101

Frequently Asked Questions

What is the IUPAC name of triethyl [(1S)-1-phenylethyl] silicate?
The IUPAC name of triethyl [(1S)-1-phenylethyl] silicate (CID 102403172) is triethyl [(1S)-1-phenylethyl] silicate.
What is the SMILES notation for triethyl [(1S)-1-phenylethyl] silicate?
The canonical SMILES for triethyl [(1S)-1-phenylethyl] silicate is CCO[Si](OCC)(OCC)O[C@@H](C)c1ccccc1.
What is the InChIKey of triethyl [(1S)-1-phenylethyl] silicate?
The InChIKey is WYUOOWKMPZFRKO-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H24O4Si/c1-5-15-19(16-6-2,17-7-3)18-13(4)14-11-9-8-10-12-14/h8-13H,5-7H2,1-4H3/t13-/m0/s1.
What are the key properties of triethyl [(1S)-1-phenylethyl] silicate?
triethyl [(1S)-1-phenylethyl] silicate has a molecular weight of 284.43 g/mol, XLogP of 3.31, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl [(1S)-1-phenylethyl] silicate is sourced from PubChem (CID 102403172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).