2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane

C12H22OSi — CID 10889176

IUPAC2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane
SMILESC=CC[Si](C)(C)OC(C(=C)C)C(=C)C
InChIInChI=1S/C12H22OSi/c1-8-9-14(6,7)13-12(10(2)3)11(4)5/h8,12H,1-2,4,9H2,3,5-7H3
InChIKeyPUEGFEFANWOSAK-UHFFFAOYSA-N
MW210.39 g/mol
LogP3.91
Rot. Bonds6

About 2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane

2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane (PubChem CID 10889176) has the molecular formula C12H22OSi and a molecular weight of 210.39 g/mol. Its IUPAC name is 2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane.

Molecular Properties

Compound Name2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane
PubChem CID10889176
Molecular FormulaC12H22OSi
Molecular Weight210.39 g/mol
Exact Mass210.14
IUPAC Name2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane
SMILESC=CC[Si](C)(C)OC(C(=C)C)C(=C)C
InChIInChI=1S/C12H22OSi/c1-8-9-14(6,7)13-12(10(2)3)11(4)5/h8,12H,1-2,4,9H2,3,5-7H3
InChIKeyPUEGFEFANWOSAK-UHFFFAOYSA-N
XLogP3.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.39
LogP ≤ 53.91
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 2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane?
The IUPAC name of 2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane (CID 10889176) is 2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane.
What is the SMILES notation for 2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane?
The canonical SMILES for 2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane is C=CC[Si](C)(C)OC(C(=C)C)C(=C)C.
What is the InChIKey of 2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane?
The InChIKey is PUEGFEFANWOSAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22OSi/c1-8-9-14(6,7)13-12(10(2)3)11(4)5/h8,12H,1-2,4,9H2,3,5-7H3.
What are the key properties of 2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane?
2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane has a molecular weight of 210.39 g/mol, XLogP of 3.91, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylpenta-1,4-dien-3-yloxy-dimethyl-prop-2-enylsilane is sourced from PubChem (CID 10889176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).