2-ethoxyhept-1-en-3-ylsilane

C9H20OSi — CID 173016361

IUPAC2-ethoxyhept-1-en-3-ylsilane
SMILESC=C(OCC)C([SiH3])CCCC
InChIInChI=1S/C9H20OSi/c1-4-6-7-9(11)8(3)10-5-2/h9H,3-7H2,1-2,11H3
InChIKeyPJAHYQFUPAPBRZ-UHFFFAOYSA-N
MW172.34 g/mol
LogP1.88
Rot. Bonds6

About 2-ethoxyhept-1-en-3-ylsilane

2-ethoxyhept-1-en-3-ylsilane (PubChem CID 173016361) has the molecular formula C9H20OSi and a molecular weight of 172.34 g/mol. Its IUPAC name is 2-ethoxyhept-1-en-3-ylsilane.

Molecular Properties

Compound Name2-ethoxyhept-1-en-3-ylsilane
PubChem CID173016361
Molecular FormulaC9H20OSi
Molecular Weight172.34 g/mol
Exact Mass172.13
IUPAC Name2-ethoxyhept-1-en-3-ylsilane
SMILESC=C(OCC)C([SiH3])CCCC
InChIInChI=1S/C9H20OSi/c1-4-6-7-9(11)8(3)10-5-2/h9H,3-7H2,1-2,11H3
InChIKeyPJAHYQFUPAPBRZ-UHFFFAOYSA-N
XLogP1.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.34
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxyhept-1-en-3-ylsilane?
The IUPAC name of 2-ethoxyhept-1-en-3-ylsilane (CID 173016361) is 2-ethoxyhept-1-en-3-ylsilane.
What is the SMILES notation for 2-ethoxyhept-1-en-3-ylsilane?
The canonical SMILES for 2-ethoxyhept-1-en-3-ylsilane is C=C(OCC)C([SiH3])CCCC.
What is the InChIKey of 2-ethoxyhept-1-en-3-ylsilane?
The InChIKey is PJAHYQFUPAPBRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20OSi/c1-4-6-7-9(11)8(3)10-5-2/h9H,3-7H2,1-2,11H3.
What are the key properties of 2-ethoxyhept-1-en-3-ylsilane?
2-ethoxyhept-1-en-3-ylsilane has a molecular weight of 172.34 g/mol, XLogP of 1.88, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxyhept-1-en-3-ylsilane is sourced from PubChem (CID 173016361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).