2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane

C19H34O3Si — CID 142630702

IUPAC2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](OCCOCCOc1ccccc1)(C(C)C)C(C)C
InChIInChI=1S/C19H34O3Si/c1-16(2)23(17(3)4,18(5)6)22-15-13-20-12-14-21-19-10-8-7-9-11-19/h7-11,16-18H,12-15H2,1-6H3
InChIKeyCEIGDBOMZZMXCC-UHFFFAOYSA-N
MW338.56 g/mol
LogP5.27
Rot. Bonds11

About 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane

2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane (PubChem CID 142630702) has the molecular formula C19H34O3Si and a molecular weight of 338.56 g/mol. Its IUPAC name is 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane
PubChem CID142630702
Molecular FormulaC19H34O3Si
Molecular Weight338.56 g/mol
Exact Mass338.23
IUPAC Name2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](OCCOCCOc1ccccc1)(C(C)C)C(C)C
InChIInChI=1S/C19H34O3Si/c1-16(2)23(17(3)4,18(5)6)22-15-13-20-12-14-21-19-10-8-7-9-11-19/h7-11,16-18H,12-15H2,1-6H3
InChIKeyCEIGDBOMZZMXCC-UHFFFAOYSA-N
XLogP5.27
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.56
LogP ≤ 55.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane?
The IUPAC name of 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane (CID 142630702) is 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane.
What is the SMILES notation for 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane?
The canonical SMILES for 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane is CC(C)[Si](OCCOCCOc1ccccc1)(C(C)C)C(C)C.
What is the InChIKey of 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane?
The InChIKey is CEIGDBOMZZMXCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34O3Si/c1-16(2)23(17(3)4,18(5)6)22-15-13-20-12-14-21-19-10-8-7-9-11-19/h7-11,16-18H,12-15H2,1-6H3.
What are the key properties of 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane?
2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane has a molecular weight of 338.56 g/mol, XLogP of 5.27, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenoxyethoxy)ethoxy-tri(propan-2-yl)silane is sourced from PubChem (CID 142630702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).