dimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol

C14H22O4Si — CID 161439221

IUPACdimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol
SMILESC[Si](C)(OCC1CO1)c1ccccc1.OCC1CO1
InChIInChI=1S/C11H16O2Si.C3H6O2/c1-14(2,13-9-10-8-12-10)11-6-4-3-5-7-11;4-1-3-2-5-3/h3-7,10H,8-9H2,1-2H3;3-4H,1-2H2
InChIKeyVZAYGMOGFIKKIU-UHFFFAOYSA-N
MW282.41 g/mol
LogP0.89
Rot. Bonds5

About dimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol

dimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol (PubChem CID 161439221) has the molecular formula C14H22O4Si and a molecular weight of 282.41 g/mol. Its IUPAC name is dimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol.

Molecular Properties

Compound Namedimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol
PubChem CID161439221
Molecular FormulaC14H22O4Si
Molecular Weight282.41 g/mol
Exact Mass282.13
IUPAC Namedimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol
SMILESC[Si](C)(OCC1CO1)c1ccccc1.OCC1CO1
InChIInChI=1S/C11H16O2Si.C3H6O2/c1-14(2,13-9-10-8-12-10)11-6-4-3-5-7-11;4-1-3-2-5-3/h3-7,10H,8-9H2,1-2H3;3-4H,1-2H2
InChIKeyVZAYGMOGFIKKIU-UHFFFAOYSA-N
XLogP0.89
TPSA54.52 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(2-methylphenoxy)methyl]oxirane;oxiran-2-ylmethanol
CID 174918196
ethenyl-(oxiran-2-ylmethoxy)-diphenylsilane
CID 21134261
ethoxymethylbenzene;oxiran-2-ylmethanol
CID 174298824
(5R)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]-1,4-dioxan-2-ol
CID 162409626
oxiran-2-ylmethanol;phenylmethoxymethylbenzene
CID 87861777
[(2R,5S)-5-[[tert-butyl(diphenyl)silyl]oxymethyl]oxolan-2-yl]methanol
CID 10981523
tris(2-ethyloxirane);tris(oxiran-2-ylmethanol);phenol
CID 159100623
diethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane
CID 139765334
hydroxy-methyl-[3-(oxiran-2-ylmethoxy)propyl]-phenylsilane
CID 101402997
sodium;tris(2-ethyloxirane);hydride;molecular hydrogen;tris(oxiran-2-ylmethanol);phenol
CID 158495864
bicyclo[2.2.2]octa-1,3,5,7-tetraene;oxiran-2-ylmethanol
CID 23187370
tert-butyl-(1,4,7,10,13,16-hexaoxacyclooctadec-2-ylmethoxy)-diphenylsilane
CID 102228442

Frequently Asked Questions

What is the IUPAC name of dimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol?
The IUPAC name of dimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol (CID 161439221) is dimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol.
What is the SMILES notation for dimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol?
The canonical SMILES for dimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol is C[Si](C)(OCC1CO1)c1ccccc1.OCC1CO1.
What is the InChIKey of dimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol?
The InChIKey is VZAYGMOGFIKKIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O2Si.C3H6O2/c1-14(2,13-9-10-8-12-10)11-6-4-3-5-7-11;4-1-3-2-5-3/h3-7,10H,8-9H2,1-2H3;3-4H,1-2H2.
What are the key properties of dimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol?
dimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol has a molecular weight of 282.41 g/mol, XLogP of 0.89, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(oxiran-2-ylmethoxy)-phenylsilane;oxiran-2-ylmethanol is sourced from PubChem (CID 161439221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).