diethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane

C15H24O4Si — CID 139765334

IUPACdiethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane
SMILESCCO[Si](CCOCC1CO1)(OCC)c1ccccc1
InChIInChI=1S/C15H24O4Si/c1-3-18-20(19-4-2,15-8-6-5-7-9-15)11-10-16-12-14-13-17-14/h5-9,14H,3-4,10-13H2,1-2H3
InChIKeyIBRVLBQDNQVSMZ-UHFFFAOYSA-N
MW296.44 g/mol
LogP1.82
Rot. Bonds10

About diethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane

diethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane (PubChem CID 139765334) has the molecular formula C15H24O4Si and a molecular weight of 296.44 g/mol. Its IUPAC name is diethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane.

Molecular Properties

Compound Namediethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane
PubChem CID139765334
Molecular FormulaC15H24O4Si
Molecular Weight296.44 g/mol
Exact Mass296.14
IUPAC Namediethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane
SMILESCCO[Si](CCOCC1CO1)(OCC)c1ccccc1
InChIInChI=1S/C15H24O4Si/c1-3-18-20(19-4-2,15-8-6-5-7-9-15)11-10-16-12-14-13-17-14/h5-9,14H,3-4,10-13H2,1-2H3
InChIKeyIBRVLBQDNQVSMZ-UHFFFAOYSA-N
XLogP1.82
TPSA40.22 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

diethoxy-[3-(oxiran-2-ylmethoxy)propyl]-phenylsilane;silane
CID 157211120
dibutoxy-[3-(oxiran-2-ylmethoxy)propyl]-phenylsilane
CID 139765356
triethoxy(phenyl)silane;trimethoxy-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 87370600
hydroxy-methyl-[3-(oxiran-2-ylmethoxy)propyl]-phenylsilane
CID 101402997
diethoxy-(9H-fluoren-1-yl)-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 151390772
diethoxy-ethyl-[2-(oxiran-2-ylmethoxy)ethyl]silane
CID 21432048
diethoxy-methyl-[15-(oxiran-2-ylmethoxy)pentadecyl]silane
CID 156812550
[4-[dimethyl-[3-(oxiran-2-ylmethoxy)propyl]silyl]phenyl]-dimethyl-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 14419243
diethoxy-phenyl-(3-propoxypropyl)silane
CID 141085456
diethoxy(dimethyl)silane;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 158655964
ethoxy-(ethoxy-methyl-phenylsilyl)-methyl-phenylsilane
CID 19809309
2-[2-(2-phenoxyethoxy)ethoxymethyl]oxirane
CID 59687579

Frequently Asked Questions

What is the IUPAC name of diethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane?
The IUPAC name of diethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane (CID 139765334) is diethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane.
What is the SMILES notation for diethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane?
The canonical SMILES for diethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane is CCO[Si](CCOCC1CO1)(OCC)c1ccccc1.
What is the InChIKey of diethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane?
The InChIKey is IBRVLBQDNQVSMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O4Si/c1-3-18-20(19-4-2,15-8-6-5-7-9-15)11-10-16-12-14-13-17-14/h5-9,14H,3-4,10-13H2,1-2H3.
What are the key properties of diethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane?
diethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane has a molecular weight of 296.44 g/mol, XLogP of 1.82, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-[2-(oxiran-2-ylmethoxy)ethyl]-phenylsilane is sourced from PubChem (CID 139765334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).