2,2-dimethyl-6-prop-1-en-2-yloxasilinane

C9H18OSi — CID 18533617

IUPAC2,2-dimethyl-6-prop-1-en-2-yloxasilinane
SMILESC=C(C)C1CCC[Si](C)(C)O1
InChIInChI=1S/C9H18OSi/c1-8(2)9-6-5-7-11(3,4)10-9/h9H,1,5-7H2,2-4H3
InChIKeyIKZCXXLBCDIEEW-UHFFFAOYSA-N
MW170.33 g/mol
LogP2.95
Rot. Bonds1

About 2,2-dimethyl-6-prop-1-en-2-yloxasilinane

2,2-dimethyl-6-prop-1-en-2-yloxasilinane (PubChem CID 18533617) has the molecular formula C9H18OSi and a molecular weight of 170.33 g/mol. Its IUPAC name is 2,2-dimethyl-6-prop-1-en-2-yloxasilinane.

Molecular Properties

Compound Name2,2-dimethyl-6-prop-1-en-2-yloxasilinane
PubChem CID18533617
Molecular FormulaC9H18OSi
Molecular Weight170.33 g/mol
Exact Mass170.11
IUPAC Name2,2-dimethyl-6-prop-1-en-2-yloxasilinane
SMILESC=C(C)C1CCC[Si](C)(C)O1
InChIInChI=1S/C9H18OSi/c1-8(2)9-6-5-7-11(3,4)10-9/h9H,1,5-7H2,2-4H3
InChIKeyIKZCXXLBCDIEEW-UHFFFAOYSA-N
XLogP2.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.33
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-6-prop-1-en-2-yloxasilinane?
The IUPAC name of 2,2-dimethyl-6-prop-1-en-2-yloxasilinane (CID 18533617) is 2,2-dimethyl-6-prop-1-en-2-yloxasilinane.
What is the SMILES notation for 2,2-dimethyl-6-prop-1-en-2-yloxasilinane?
The canonical SMILES for 2,2-dimethyl-6-prop-1-en-2-yloxasilinane is C=C(C)C1CCC[Si](C)(C)O1.
What is the InChIKey of 2,2-dimethyl-6-prop-1-en-2-yloxasilinane?
The InChIKey is IKZCXXLBCDIEEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18OSi/c1-8(2)9-6-5-7-11(3,4)10-9/h9H,1,5-7H2,2-4H3.
What are the key properties of 2,2-dimethyl-6-prop-1-en-2-yloxasilinane?
2,2-dimethyl-6-prop-1-en-2-yloxasilinane has a molecular weight of 170.33 g/mol, XLogP of 2.95, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-prop-1-en-2-yloxasilinane is sourced from PubChem (CID 18533617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).