2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane

C13H28O2Si — CID 91733069

IUPAC2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane
SMILESC=C[Si](C)(OC(C)C)OC(C(C)C)C(C)C
InChIInChI=1S/C13H28O2Si/c1-9-16(8,14-12(6)7)15-13(10(2)3)11(4)5/h9-13H,1H2,2-8H3
InChIKeyDEZHCSPAUGNRIP-UHFFFAOYSA-N
MW244.45 g/mol
LogP3.91
Rot. Bonds7

About 2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane

2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane (PubChem CID 91733069) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is 2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane.

Molecular Properties

Compound Name2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane
PubChem CID91733069
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Name2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane
SMILESC=C[Si](C)(OC(C)C)OC(C(C)C)C(C)C
InChIInChI=1S/C13H28O2Si/c1-9-16(8,14-12(6)7)15-13(10(2)3)11(4)5/h9-13H,1H2,2-8H3
InChIKeyDEZHCSPAUGNRIP-UHFFFAOYSA-N
XLogP3.91
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane?
The IUPAC name of 2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane (CID 91733069) is 2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane.
What is the SMILES notation for 2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane?
The canonical SMILES for 2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane is C=C[Si](C)(OC(C)C)OC(C(C)C)C(C)C.
What is the InChIKey of 2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane?
The InChIKey is DEZHCSPAUGNRIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-9-16(8,14-12(6)7)15-13(10(2)3)11(4)5/h9-13H,1H2,2-8H3.
What are the key properties of 2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane?
2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane has a molecular weight of 244.45 g/mol, XLogP of 3.91, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethylpentan-3-yloxy-ethenyl-methyl-propan-2-yloxysilane is sourced from PubChem (CID 91733069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).