3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane

C15H30OSi — CID 20707279

IUPAC3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane
SMILESC=CC[Si](C)(C)OCCC(C)CCC=C(C)C
InChIInChI=1S/C15H30OSi/c1-7-13-17(5,6)16-12-11-15(4)10-8-9-14(2)3/h7,9,15H,1,8,10-13H2,2-6H3
InChIKeyBGHVBYRSPQMVME-UHFFFAOYSA-N
MW254.49 g/mol
LogP5.17
Rot. Bonds9

About 3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane

3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane (PubChem CID 20707279) has the molecular formula C15H30OSi and a molecular weight of 254.49 g/mol. Its IUPAC name is 3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane.

Molecular Properties

Compound Name3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane
PubChem CID20707279
Molecular FormulaC15H30OSi
Molecular Weight254.49 g/mol
Exact Mass254.21
IUPAC Name3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane
SMILESC=CC[Si](C)(C)OCCC(C)CCC=C(C)C
InChIInChI=1S/C15H30OSi/c1-7-13-17(5,6)16-12-11-15(4)10-8-9-14(2)3/h7,9,15H,1,8,10-13H2,2-6H3
InChIKeyBGHVBYRSPQMVME-UHFFFAOYSA-N
XLogP5.17
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.49
LogP ≤ 55.17
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 3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane?
The IUPAC name of 3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane (CID 20707279) is 3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane.
What is the SMILES notation for 3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane?
The canonical SMILES for 3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane is C=CC[Si](C)(C)OCCC(C)CCC=C(C)C.
What is the InChIKey of 3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane?
The InChIKey is BGHVBYRSPQMVME-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30OSi/c1-7-13-17(5,6)16-12-11-15(4)10-8-9-14(2)3/h7,9,15H,1,8,10-13H2,2-6H3.
What are the key properties of 3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane?
3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane has a molecular weight of 254.49 g/mol, XLogP of 5.17, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dimethyloct-6-enoxy-dimethyl-prop-2-enylsilane is sourced from PubChem (CID 20707279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).