2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane

C14H28O3Si — CID 19886951

IUPAC2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane
SMILESC=CCOC(C)OC(CC)[Si]1(C)CCCC(C)O1
InChIInChI=1S/C14H28O3Si/c1-6-10-15-13(4)16-14(7-2)18(5)11-8-9-12(3)17-18/h6,12-14H,1,7-11H2,2-5H3
InChIKeyUZNZRBHXZNBTPB-UHFFFAOYSA-N
MW272.46 g/mol
LogP3.64
Rot. Bonds7

About 2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane

2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane (PubChem CID 19886951) has the molecular formula C14H28O3Si and a molecular weight of 272.46 g/mol. Its IUPAC name is 2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane.

Molecular Properties

Compound Name2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane
PubChem CID19886951
Molecular FormulaC14H28O3Si
Molecular Weight272.46 g/mol
Exact Mass272.18
IUPAC Name2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane
SMILESC=CCOC(C)OC(CC)[Si]1(C)CCCC(C)O1
InChIInChI=1S/C14H28O3Si/c1-6-10-15-13(4)16-14(7-2)18(5)11-8-9-12(3)17-18/h6,12-14H,1,7-11H2,2-5H3
InChIKeyUZNZRBHXZNBTPB-UHFFFAOYSA-N
XLogP3.64
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.46
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane?
The IUPAC name of 2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane (CID 19886951) is 2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane.
What is the SMILES notation for 2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane?
The canonical SMILES for 2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane is C=CCOC(C)OC(CC)[Si]1(C)CCCC(C)O1.
What is the InChIKey of 2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane?
The InChIKey is UZNZRBHXZNBTPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O3Si/c1-6-10-15-13(4)16-14(7-2)18(5)11-8-9-12(3)17-18/h6,12-14H,1,7-11H2,2-5H3.
What are the key properties of 2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane?
2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane has a molecular weight of 272.46 g/mol, XLogP of 3.64, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-2-[1-(1-prop-2-enoxyethoxy)propyl]oxasilinane is sourced from PubChem (CID 19886951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).