1,1,2,2-tetraethoxysilinane

C13H28O4Si — CID 174248265

IUPAC1,1,2,2-tetraethoxysilinane
SMILESCCOC1(OCC)CCCC[Si]1(OCC)OCC
InChIInChI=1S/C13H28O4Si/c1-5-14-13(15-6-2)11-9-10-12-18(13,16-7-3)17-8-4/h5-12H2,1-4H3
InChIKeyJYCXMNMWYQHEPE-UHFFFAOYSA-N
MW276.45 g/mol
LogP2.99
Rot. Bonds8

About 1,1,2,2-tetraethoxysilinane

1,1,2,2-tetraethoxysilinane (PubChem CID 174248265) has the molecular formula C13H28O4Si and a molecular weight of 276.45 g/mol. Its IUPAC name is 1,1,2,2-tetraethoxysilinane.

Molecular Properties

Compound Name1,1,2,2-tetraethoxysilinane
PubChem CID174248265
Molecular FormulaC13H28O4Si
Molecular Weight276.45 g/mol
Exact Mass276.18
IUPAC Name1,1,2,2-tetraethoxysilinane
SMILESCCOC1(OCC)CCCC[Si]1(OCC)OCC
InChIInChI=1S/C13H28O4Si/c1-5-14-13(15-6-2)11-9-10-12-18(13,16-7-3)17-8-4/h5-12H2,1-4H3
InChIKeyJYCXMNMWYQHEPE-UHFFFAOYSA-N
XLogP2.99
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.45
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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

2-cyclopropyl-1,1,2-triethoxysilinane
CID 174341764
propanoic acid;1,1,2-triethoxy-2-ethylsilinane
CID 174783066
(1,1,2-triethoxysilinan-2-yl)methyl acetate
CID 174525349
4-methylpent-1-ene;1,1,2-triethoxy-2-ethylsilinane
CID 174706087
toluene;1,1,2-triethoxy-2-ethylsilinane
CID 174816258
N-methylprop-2-enamide;1,1,2-triethoxy-2-ethylsilinane
CID 174864706
phenanthrene;1,1,2-triethoxy-2-ethylsilinane
CID 174932363
5-(1,1,2-triethoxysilinan-2-yl)pentane-1,3-diamine
CID 174522138
phenyl hypochlorite;1,1,2-triethoxy-2-ethylsilinane
CID 174609072
4-chlorophenol;1,1,2-triethoxy-2-ethylsilinane
CID 174609070
ethynylbenzene;1,2,2-triethoxy-1-ethylsilinane
CID 174931569
2-ethyl-3-[4-(1,1,2-triethoxysilinan-2-yl)butyl]oxirane
CID 174976602

Frequently Asked Questions

What is the IUPAC name of 1,1,2,2-tetraethoxysilinane?
The IUPAC name of 1,1,2,2-tetraethoxysilinane (CID 174248265) is 1,1,2,2-tetraethoxysilinane.
What is the SMILES notation for 1,1,2,2-tetraethoxysilinane?
The canonical SMILES for 1,1,2,2-tetraethoxysilinane is CCOC1(OCC)CCCC[Si]1(OCC)OCC.
What is the InChIKey of 1,1,2,2-tetraethoxysilinane?
The InChIKey is JYCXMNMWYQHEPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O4Si/c1-5-14-13(15-6-2)11-9-10-12-18(13,16-7-3)17-8-4/h5-12H2,1-4H3.
What are the key properties of 1,1,2,2-tetraethoxysilinane?
1,1,2,2-tetraethoxysilinane has a molecular weight of 276.45 g/mol, XLogP of 2.99, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2,2-tetraethoxysilinane is sourced from PubChem (CID 174248265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).