1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane

C18H36O4Si2 — CID 173009357

IUPAC1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane
SMILESC=CC(OCC)(OCC)[SiH2]CC=CC[SiH2]C(C=C)(OCC)OCC
InChIInChI=1S/C18H36O4Si2/c1-7-17(19-9-3,20-10-4)23-15-13-14-16-24-18(8-2,21-11-5)22-12-6/h7-8,13-14H,1-2,9-12,15-16,23-24H2,3-6H3
InChIKeyYZOFXZJLJJKZQN-UHFFFAOYSA-N
MW372.65 g/mol
LogP2.54
Rot. Bonds16

About 1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane

1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane (PubChem CID 173009357) has the molecular formula C18H36O4Si2 and a molecular weight of 372.65 g/mol. Its IUPAC name is 1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane.

Molecular Properties

Compound Name1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane
PubChem CID173009357
Molecular FormulaC18H36O4Si2
Molecular Weight372.65 g/mol
Exact Mass372.22
IUPAC Name1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane
SMILESC=CC(OCC)(OCC)[SiH2]CC=CC[SiH2]C(C=C)(OCC)OCC
InChIInChI=1S/C18H36O4Si2/c1-7-17(19-9-3,20-10-4)23-15-13-14-16-24-18(8-2,21-11-5)22-12-6/h7-8,13-14H,1-2,9-12,15-16,23-24H2,3-6H3
InChIKeyYZOFXZJLJJKZQN-UHFFFAOYSA-N
XLogP2.54
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.65
LogP ≤ 52.54
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane?
The IUPAC name of 1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane (CID 173009357) is 1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane.
What is the SMILES notation for 1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane?
The canonical SMILES for 1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane is C=CC(OCC)(OCC)[SiH2]CC=CC[SiH2]C(C=C)(OCC)OCC.
What is the InChIKey of 1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane?
The InChIKey is YZOFXZJLJJKZQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36O4Si2/c1-7-17(19-9-3,20-10-4)23-15-13-14-16-24-18(8-2,21-11-5)22-12-6/h7-8,13-14H,1-2,9-12,15-16,23-24H2,3-6H3.
What are the key properties of 1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane?
1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane has a molecular weight of 372.65 g/mol, XLogP of 2.54, 16 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-diethoxyprop-2-enyl-[4-(1,1-diethoxyprop-2-enylsilyl)but-2-enyl]silane is sourced from PubChem (CID 173009357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).