2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane

C14H26OSi — CID 11264920

IUPAC2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane
SMILESC=CC[Si](C)(C)OC(CC(=C)C)CC(=C)C
InChIInChI=1S/C14H26OSi/c1-8-9-16(6,7)15-14(10-12(2)3)11-13(4)5/h8,14H,1-2,4,9-11H2,3,5-7H3
InChIKeyQIGXUDHGUBDXEW-UHFFFAOYSA-N
MW238.45 g/mol
LogP4.70
Rot. Bonds8

About 2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane

2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane (PubChem CID 11264920) has the molecular formula C14H26OSi and a molecular weight of 238.45 g/mol. Its IUPAC name is 2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane.

Molecular Properties

Compound Name2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane
PubChem CID11264920
Molecular FormulaC14H26OSi
Molecular Weight238.45 g/mol
Exact Mass238.18
IUPAC Name2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane
SMILESC=CC[Si](C)(C)OC(CC(=C)C)CC(=C)C
InChIInChI=1S/C14H26OSi/c1-8-9-16(6,7)15-14(10-12(2)3)11-13(4)5/h8,14H,1-2,4,9-11H2,3,5-7H3
InChIKeyQIGXUDHGUBDXEW-UHFFFAOYSA-N
XLogP4.70
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.45
LogP ≤ 54.70
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 2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane?
The IUPAC name of 2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane (CID 11264920) is 2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane.
What is the SMILES notation for 2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane?
The canonical SMILES for 2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane is C=CC[Si](C)(C)OC(CC(=C)C)CC(=C)C.
What is the InChIKey of 2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane?
The InChIKey is QIGXUDHGUBDXEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26OSi/c1-8-9-16(6,7)15-14(10-12(2)3)11-13(4)5/h8,14H,1-2,4,9-11H2,3,5-7H3.
What are the key properties of 2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane?
2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane has a molecular weight of 238.45 g/mol, XLogP of 4.70, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethylhepta-1,6-dien-4-yloxy-dimethyl-prop-2-enylsilane is sourced from PubChem (CID 11264920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).