triethoxy-(2-phenyloxan-2-yl)silane

C17H28O4Si — CID 175435883

IUPACtriethoxy-(2-phenyloxan-2-yl)silane
SMILESCCO[Si](OCC)(OCC)C1(c2ccccc2)CCCCO1
InChIInChI=1S/C17H28O4Si/c1-4-19-22(20-5-2,21-6-3)17(14-10-11-15-18-17)16-12-8-7-9-13-16/h7-9,12-13H,4-6,10-11,14-15H2,1-3H3
InChIKeyMCUCGCDAILSSRG-UHFFFAOYSA-N
MW324.49 g/mol
LogP3.67
Rot. Bonds8

About triethoxy-(2-phenyloxan-2-yl)silane

triethoxy-(2-phenyloxan-2-yl)silane (PubChem CID 175435883) has the molecular formula C17H28O4Si and a molecular weight of 324.49 g/mol. Its IUPAC name is triethoxy-(2-phenyloxan-2-yl)silane.

Molecular Properties

Compound Nametriethoxy-(2-phenyloxan-2-yl)silane
PubChem CID175435883
Molecular FormulaC17H28O4Si
Molecular Weight324.49 g/mol
Exact Mass324.18
IUPAC Nametriethoxy-(2-phenyloxan-2-yl)silane
SMILESCCO[Si](OCC)(OCC)C1(c2ccccc2)CCCCO1
InChIInChI=1S/C17H28O4Si/c1-4-19-22(20-5-2,21-6-3)17(14-10-11-15-18-17)16-12-8-7-9-13-16/h7-9,12-13H,4-6,10-11,14-15H2,1-3H3
InChIKeyMCUCGCDAILSSRG-UHFFFAOYSA-N
XLogP3.67
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.49
LogP ≤ 53.67
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

2-ethoxy-2-phenyl-1,3-dioxane
CID 86143567
dimethoxy-(2-phenyloxan-2-yl)silane
CID 174844797
(6S)-8,8-diphenyl-1,7-dioxaspiro[5.6]dodecane
CID 102454041
(2-phenyloxan-2-yl)silane
CID 123975784
3-(2-phenyloxan-2-yl)propan-1-ol
CID 66685490
trimethyl-[(2S)-2-phenyloxiran-2-yl]silane
CID 135037115
1,1-diphenylcyclotetradecane
CID 175822005
2-[3-(methoxymethoxy)phenyl]-2-[2-[3-(methoxymethoxy)phenyl]oxan-2-yl]oxyoxane
CID 155665805
ethoxy-(ethoxy-methyl-phenylsilyl)-methyl-phenylsilane
CID 19809309
1-(1-phenylcyclopentyl)propan-1-one
CID 63080096
(1R,14R)-1,14-diphenyl-2,6,9,13-tetraoxabicyclo[12.4.0]octadecane
CID 15361394
CID 102302966
CID 102302966

Frequently Asked Questions

What is the IUPAC name of triethoxy-(2-phenyloxan-2-yl)silane?
The IUPAC name of triethoxy-(2-phenyloxan-2-yl)silane (CID 175435883) is triethoxy-(2-phenyloxan-2-yl)silane.
What is the SMILES notation for triethoxy-(2-phenyloxan-2-yl)silane?
The canonical SMILES for triethoxy-(2-phenyloxan-2-yl)silane is CCO[Si](OCC)(OCC)C1(c2ccccc2)CCCCO1.
What is the InChIKey of triethoxy-(2-phenyloxan-2-yl)silane?
The InChIKey is MCUCGCDAILSSRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28O4Si/c1-4-19-22(20-5-2,21-6-3)17(14-10-11-15-18-17)16-12-8-7-9-13-16/h7-9,12-13H,4-6,10-11,14-15H2,1-3H3.
What are the key properties of triethoxy-(2-phenyloxan-2-yl)silane?
triethoxy-(2-phenyloxan-2-yl)silane has a molecular weight of 324.49 g/mol, XLogP of 3.67, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-(2-phenyloxan-2-yl)silane is sourced from PubChem (CID 175435883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).