triethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane

C19H34O5Si — CID 123955246

IUPACtriethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane
SMILESCCOC(C)Oc1ccc(CCC[Si](OCC)(OCC)OCC)cc1
InChIInChI=1S/C19H34O5Si/c1-6-20-17(5)24-19-14-12-18(13-15-19)11-10-16-25(21-7-2,22-8-3)23-9-4/h12-15,17H,6-11,16H2,1-5H3
InChIKeySSWLCJHKNLUQIA-UHFFFAOYSA-N
MW370.56 g/mol
LogP4.43
Rot. Bonds14

About triethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane

triethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane (PubChem CID 123955246) has the molecular formula C19H34O5Si and a molecular weight of 370.56 g/mol. Its IUPAC name is triethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane.

Molecular Properties

Compound Nametriethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane
PubChem CID123955246
Molecular FormulaC19H34O5Si
Molecular Weight370.56 g/mol
Exact Mass370.22
IUPAC Nametriethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane
SMILESCCOC(C)Oc1ccc(CCC[Si](OCC)(OCC)OCC)cc1
InChIInChI=1S/C19H34O5Si/c1-6-20-17(5)24-19-14-12-18(13-15-19)11-10-16-25(21-7-2,22-8-3)23-9-4/h12-15,17H,6-11,16H2,1-5H3
InChIKeySSWLCJHKNLUQIA-UHFFFAOYSA-N
XLogP4.43
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.56
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

triethoxy-[[4-(1-ethoxyethoxy)phenyl]methyl]silane;triethoxy-[4-(1-ethoxyethoxy)phenyl]silane;triethoxy-[(4-prop-2-enoxyphenyl)methyl]silane;triethoxy-[3-(4-prop-2-enoxyphenyl)propyl]silane;triethoxy-(4-prop-2-enoxyphenyl)silane
CID 159000118
1,4-bis(1-ethoxyethoxy)benzene
CID 10934047
1,4-bis[bis[4-(1-ethoxyethoxy)phenyl]methyl]benzene
CID 90276539
2-[4-(1-bromoethyl)phenyl]ethyl-triethoxysilane
CID 66846155
[4-[4-(1-ethoxyethoxy)phenyl]-2-methylbutan-2-yl]-oxosilane
CID 123166160
4-[[4-(1-ethoxyethoxy)phenyl]methyl]phenol
CID 23546598
4-(1-ethoxyethoxy)aniline
CID 139920192
1-(1-ethoxyethoxy)-4-[4-(1-ethoxyethoxy)phenyl]tellanylbenzene
CID 140901390
1-[1,1-bis[4-(1-ethoxyethoxy)phenyl]ethyl]-4-(1-ethoxyethoxy)benzene
CID 22726285
1-(1-ethoxyethoxy)-4-(2,2,5-trimethylheptan-3-yl)benzene
CID 123183893
triethoxy-[(4-prop-2-enoxyphenyl)methyl]silane;triethoxy-[3-(4-prop-2-enoxyphenyl)propyl]silane;triethoxy-(4-prop-2-enoxyphenyl)silane
CID 158445572
1-butan-2-yl-4-[1-(4-phenylbutoxy)ethoxy]benzene
CID 21363315

Frequently Asked Questions

What is the IUPAC name of triethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane?
The IUPAC name of triethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane (CID 123955246) is triethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane.
What is the SMILES notation for triethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane?
The canonical SMILES for triethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane is CCOC(C)Oc1ccc(CCC[Si](OCC)(OCC)OCC)cc1.
What is the InChIKey of triethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane?
The InChIKey is SSWLCJHKNLUQIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34O5Si/c1-6-20-17(5)24-19-14-12-18(13-15-19)11-10-16-25(21-7-2,22-8-3)23-9-4/h12-15,17H,6-11,16H2,1-5H3.
What are the key properties of triethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane?
triethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane has a molecular weight of 370.56 g/mol, XLogP of 4.43, 14 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[3-[4-(1-ethoxyethoxy)phenyl]propyl]silane is sourced from PubChem (CID 123955246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).