3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane

C14H30O5Si — CID 174814870

IUPAC3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane
SMILESC=CC(OC)OC.C=CC[Si](OCC)(OCC)OCC
InChIInChI=1S/C9H20O3Si.C5H10O2/c1-5-9-13(10-6-2,11-7-3)12-8-4;1-4-5(6-2)7-3/h5H,1,6-9H2,2-4H3;4-5H,1H2,2-3H3
InChIKeyKYXOINFGTNGMIK-UHFFFAOYSA-N
MW306.48 g/mol
LogP3.01
Rot. Bonds11

About 3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane

3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane (PubChem CID 174814870) has the molecular formula C14H30O5Si and a molecular weight of 306.48 g/mol. Its IUPAC name is 3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane.

Molecular Properties

Compound Name3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane
PubChem CID174814870
Molecular FormulaC14H30O5Si
Molecular Weight306.48 g/mol
Exact Mass306.19
IUPAC Name3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane
SMILESC=CC(OC)OC.C=CC[Si](OCC)(OCC)OCC
InChIInChI=1S/C9H20O3Si.C5H10O2/c1-5-9-13(10-6-2,11-7-3)12-8-4;1-4-5(6-2)7-3/h5H,1,6-9H2,2-4H3;4-5H,1H2,2-3H3
InChIKeyKYXOINFGTNGMIK-UHFFFAOYSA-N
XLogP3.01
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.48
LogP ≤ 53.01
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane?
The IUPAC name of 3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane (CID 174814870) is 3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane.
What is the SMILES notation for 3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane?
The canonical SMILES for 3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane is C=CC(OC)OC.C=CC[Si](OCC)(OCC)OCC.
What is the InChIKey of 3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane?
The InChIKey is KYXOINFGTNGMIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O3Si.C5H10O2/c1-5-9-13(10-6-2,11-7-3)12-8-4;1-4-5(6-2)7-3/h5H,1,6-9H2,2-4H3;4-5H,1H2,2-3H3.
What are the key properties of 3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane?
3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane has a molecular weight of 306.48 g/mol, XLogP of 3.01, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethoxyprop-1-ene;triethoxy(prop-2-enyl)silane is sourced from PubChem (CID 174814870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).