ethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane

C19H38O6Si — CID 150670600

IUPACethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane
SMILESC=CC(O[Si](C=C)(OCC)OCC)C(OC(C)C)(OC(C)C)OC(C)C
InChIInChI=1S/C19H38O6Si/c1-11-18(25-26(14-4,20-12-2)21-13-3)19(22-15(5)6,23-16(7)8)24-17(9)10/h11,14-18H,1,4,12-13H2,2-3,5-10H3
InChIKeyJFUIZCAJRUKKSW-UHFFFAOYSA-N
MW390.59 g/mol
LogP4.22
Rot. Bonds15

About ethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane

ethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane (PubChem CID 150670600) has the molecular formula C19H38O6Si and a molecular weight of 390.59 g/mol. Its IUPAC name is ethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane.

Molecular Properties

Compound Nameethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane
PubChem CID150670600
Molecular FormulaC19H38O6Si
Molecular Weight390.59 g/mol
Exact Mass390.24
IUPAC Nameethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane
SMILESC=CC(O[Si](C=C)(OCC)OCC)C(OC(C)C)(OC(C)C)OC(C)C
InChIInChI=1S/C19H38O6Si/c1-11-18(25-26(14-4,20-12-2)21-13-3)19(22-15(5)6,23-16(7)8)24-17(9)10/h11,14-18H,1,4,12-13H2,2-3,5-10H3
InChIKeyJFUIZCAJRUKKSW-UHFFFAOYSA-N
XLogP4.22
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.59
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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 ethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane?
The IUPAC name of ethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane (CID 150670600) is ethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane.
What is the SMILES notation for ethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane?
The canonical SMILES for ethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane is C=CC(O[Si](C=C)(OCC)OCC)C(OC(C)C)(OC(C)C)OC(C)C.
What is the InChIKey of ethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane?
The InChIKey is JFUIZCAJRUKKSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38O6Si/c1-11-18(25-26(14-4,20-12-2)21-13-3)19(22-15(5)6,23-16(7)8)24-17(9)10/h11,14-18H,1,4,12-13H2,2-3,5-10H3.
What are the key properties of ethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane?
ethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane has a molecular weight of 390.59 g/mol, XLogP of 4.22, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-diethoxy-[1,1,1-tri(propan-2-yloxy)but-3-en-2-yloxy]silane is sourced from PubChem (CID 150670600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).