1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane

C14H28O4Si — CID 174492175

IUPAC1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane
SMILESC=CCOC1CCC[Si](OC)(OC)C1(CCC)OC
InChIInChI=1S/C14H28O4Si/c1-6-10-14(15-3)13(18-11-7-2)9-8-12-19(14,16-4)17-5/h7,13H,2,6,8-12H2,1,3-5H3
InChIKeyAVIZTJPQXTYXCD-UHFFFAOYSA-N
MW288.46 g/mol
LogP2.81
Rot. Bonds8

About 1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane

1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane (PubChem CID 174492175) has the molecular formula C14H28O4Si and a molecular weight of 288.46 g/mol. Its IUPAC name is 1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane.

Molecular Properties

Compound Name1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane
PubChem CID174492175
Molecular FormulaC14H28O4Si
Molecular Weight288.46 g/mol
Exact Mass288.18
IUPAC Name1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane
SMILESC=CCOC1CCC[Si](OC)(OC)C1(CCC)OC
InChIInChI=1S/C14H28O4Si/c1-6-10-14(15-3)13(18-11-7-2)9-8-12-19(14,16-4)17-5/h7,13H,2,6,8-12H2,1,3-5H3
InChIKeyAVIZTJPQXTYXCD-UHFFFAOYSA-N
XLogP2.81
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.46
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane?
The IUPAC name of 1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane (CID 174492175) is 1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane.
What is the SMILES notation for 1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane?
The canonical SMILES for 1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane is C=CCOC1CCC[Si](OC)(OC)C1(CCC)OC.
What is the InChIKey of 1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane?
The InChIKey is AVIZTJPQXTYXCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O4Si/c1-6-10-14(15-3)13(18-11-7-2)9-8-12-19(14,16-4)17-5/h7,13H,2,6,8-12H2,1,3-5H3.
What are the key properties of 1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane?
1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane has a molecular weight of 288.46 g/mol, XLogP of 2.81, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2-trimethoxy-3-prop-2-enoxy-2-propylsilinane is sourced from PubChem (CID 174492175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).