1-ethyl-1-undec-10-enoxysilinane

C18H36OSi — CID 575276

IUPAC1-ethyl-1-undec-10-enoxysilinane
SMILESC=CCCCCCCCCCO[Si]1(CC)CCCCC1
InChIInChI=1S/C18H36OSi/c1-3-5-6-7-8-9-10-11-13-16-19-20(4-2)17-14-12-15-18-20/h3H,1,4-18H2,2H3
InChIKeyKXMYNIQMLJQOOM-UHFFFAOYSA-N
MW296.57 g/mol
LogP6.46
Rot. Bonds12

About 1-ethyl-1-undec-10-enoxysilinane

1-ethyl-1-undec-10-enoxysilinane (PubChem CID 575276) has the molecular formula C18H36OSi and a molecular weight of 296.57 g/mol. Its IUPAC name is 1-ethyl-1-undec-10-enoxysilinane.

Molecular Properties

Compound Name1-ethyl-1-undec-10-enoxysilinane
PubChem CID575276
Molecular FormulaC18H36OSi
Molecular Weight296.57 g/mol
Exact Mass296.25
IUPAC Name1-ethyl-1-undec-10-enoxysilinane
SMILESC=CCCCCCCCCCO[Si]1(CC)CCCCC1
InChIInChI=1S/C18H36OSi/c1-3-5-6-7-8-9-10-11-13-16-19-20(4-2)17-14-12-15-18-20/h3H,1,4-18H2,2H3
InChIKeyKXMYNIQMLJQOOM-UHFFFAOYSA-N
XLogP6.46
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.57
LogP ≤ 56.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-(chloromethyl)-1-undec-10-enoxysilinane
CID 575282
1-ethyl-1-octoxysilinane
CID 614794
cyclopentane;hept-1-ene
CID 159296541
12-dodec-11-enoxydodec-1-ene
CID 87325659
11-(2-ethoxyethoxy)undec-1-ene
CID 142718569
11-[2-(2-ethoxyethoxy)ethoxy]undec-1-ene
CID 142718592
heptacosa-1,26-diene
CID 58905535
heptadeca-1,16-diene
CID 6429392
oct-7-enoxymethylcyclohexane
CID 53248071
octadeca-1,17-diene;tetradec-1-ene
CID 173070986
octadec-1-ene;tetradec-1-ene
CID 158470925
non-1-ene
CID 141296734

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-1-undec-10-enoxysilinane?
The IUPAC name of 1-ethyl-1-undec-10-enoxysilinane (CID 575276) is 1-ethyl-1-undec-10-enoxysilinane.
What is the SMILES notation for 1-ethyl-1-undec-10-enoxysilinane?
The canonical SMILES for 1-ethyl-1-undec-10-enoxysilinane is C=CCCCCCCCCCO[Si]1(CC)CCCCC1.
What is the InChIKey of 1-ethyl-1-undec-10-enoxysilinane?
The InChIKey is KXMYNIQMLJQOOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36OSi/c1-3-5-6-7-8-9-10-11-13-16-19-20(4-2)17-14-12-15-18-20/h3H,1,4-18H2,2H3.
What are the key properties of 1-ethyl-1-undec-10-enoxysilinane?
1-ethyl-1-undec-10-enoxysilinane has a molecular weight of 296.57 g/mol, XLogP of 6.46, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-1-undec-10-enoxysilinane is sourced from PubChem (CID 575276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).