1,1,2-trimethoxy-2,3-dipropylsilinane

C14H30O3Si — CID 174589925

IUPAC1,1,2-trimethoxy-2,3-dipropylsilinane
SMILESCCCC1CCC[Si](OC)(OC)C1(CCC)OC
InChIInChI=1S/C14H30O3Si/c1-6-9-13-10-8-12-18(16-4,17-5)14(13,15-3)11-7-2/h13H,6-12H2,1-5H3
InChIKeyAEEGYKPQNPQOLR-UHFFFAOYSA-N
MW274.48 g/mol
LogP3.66
Rot. Bonds7

About 1,1,2-trimethoxy-2,3-dipropylsilinane

1,1,2-trimethoxy-2,3-dipropylsilinane (PubChem CID 174589925) has the molecular formula C14H30O3Si and a molecular weight of 274.48 g/mol. Its IUPAC name is 1,1,2-trimethoxy-2,3-dipropylsilinane.

Molecular Properties

Compound Name1,1,2-trimethoxy-2,3-dipropylsilinane
PubChem CID174589925
Molecular FormulaC14H30O3Si
Molecular Weight274.48 g/mol
Exact Mass274.20
IUPAC Name1,1,2-trimethoxy-2,3-dipropylsilinane
SMILESCCCC1CCC[Si](OC)(OC)C1(CCC)OC
InChIInChI=1S/C14H30O3Si/c1-6-9-13-10-8-12-18(16-4,17-5)14(13,15-3)11-7-2/h13H,6-12H2,1-5H3
InChIKeyAEEGYKPQNPQOLR-UHFFFAOYSA-N
XLogP3.66
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.48
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1,2-trimethoxy-2,3-dipropylsilinane?
The IUPAC name of 1,1,2-trimethoxy-2,3-dipropylsilinane (CID 174589925) is 1,1,2-trimethoxy-2,3-dipropylsilinane.
What is the SMILES notation for 1,1,2-trimethoxy-2,3-dipropylsilinane?
The canonical SMILES for 1,1,2-trimethoxy-2,3-dipropylsilinane is CCCC1CCC[Si](OC)(OC)C1(CCC)OC.
What is the InChIKey of 1,1,2-trimethoxy-2,3-dipropylsilinane?
The InChIKey is AEEGYKPQNPQOLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O3Si/c1-6-9-13-10-8-12-18(16-4,17-5)14(13,15-3)11-7-2/h13H,6-12H2,1-5H3.
What are the key properties of 1,1,2-trimethoxy-2,3-dipropylsilinane?
1,1,2-trimethoxy-2,3-dipropylsilinane has a molecular weight of 274.48 g/mol, XLogP of 3.66, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2-trimethoxy-2,3-dipropylsilinane is sourced from PubChem (CID 174589925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).