2,4-dimethylpentan-3-yloxy-ethenyl-ethoxy-methylsilane

C12H26O2Si — CID 91730048

IUPAC2,4-dimethylpentan-3-yloxy-ethenyl-ethoxy-methylsilane
SMILESC=C[Si](C)(OCC)OC(C(C)C)C(C)C
InChIInChI=1S/C12H26O2Si/c1-8-13-15(7,9-2)14-12(10(3)4)11(5)6/h9-12H,2,8H2,1,3-7H3
InChIKeyIJUVCIUPPNTGFF-UHFFFAOYSA-N
MW230.42 g/mol
LogP3.52
Rot. Bonds7

About 2,4-dimethylpentan-3-yloxy-ethenyl-ethoxy-methylsilane

2,4-dimethylpentan-3-yloxy-ethenyl-ethoxy-methylsilane (PubChem CID 91730048) has the molecular formula C12H26O2Si and a molecular weight of 230.42 g/mol. Its IUPAC name is 2,4-dimethylpentan-3-yloxy-ethenyl-ethoxy-methylsilane.

Molecular Properties

Compound Name2,4-dimethylpentan-3-yloxy-ethenyl-ethoxy-methylsilane
PubChem CID91730048
Molecular FormulaC12H26O2Si
Molecular Weight230.42 g/mol
Exact Mass230.17
IUPAC Name2,4-dimethylpentan-3-yloxy-ethenyl-ethoxy-methylsilane
SMILESC=C[Si](C)(OCC)OC(C(C)C)C(C)C
InChIInChI=1S/C12H26O2Si/c1-8-13-15(7,9-2)14-12(10(3)4)11(5)6/h9-12H,2,8H2,1,3-7H3
InChIKeyIJUVCIUPPNTGFF-UHFFFAOYSA-N
XLogP3.52
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Silane, methylvinyldi(3-methylbutoxy)-
CID 91736447
2-Methyl-3-pentanol, tert-butyldimethylsilyl ether
CID 91697285
Silane, diethylisobutoxy(2-methylpent-3-yloxy)-
CID 91699875
Silane, methylvinyl(2-methylpent-3-yloxy)ethoxy-
CID 91708654
Silane, dimethyl(2-methylpent-3-yloxy)propoxy-
CID 91709966
Silane, methylvinyl(2-methylpent-3-yloxy)propoxy-
CID 91713866
Silane, methylvinyl(2-methylpent-3-yloxy)butoxy-
CID 91718375
Silane, methylvinyl(2,4,4-trimethylpentyloxy)isopropoxy-
CID 91723174
Silane, methylvinyl(pent-2-yloxy)ethoxy-
CID 91723233
Silane, dimethyl(4-methylpent-2-yloxy)propoxy-
CID 91723692
Silane, methylvinyl(pent-2-yloxy)propoxy-
CID 91726227
Silane, methylvinyl(pent-2-yloxy)isopropoxy-
CID 91726393

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethylpentan-3-yloxy-ethenyl-ethoxy-methylsilane?
The IUPAC name of 2,4-dimethylpentan-3-yloxy-ethenyl-ethoxy-methylsilane (CID 91730048) is 2,4-dimethylpentan-3-yloxy-ethenyl-ethoxy-methylsilane.
What is the SMILES notation for 2,4-dimethylpentan-3-yloxy-ethenyl-ethoxy-methylsilane?
The canonical SMILES for 2,4-dimethylpentan-3-yloxy-ethenyl-ethoxy-methylsilane is C=C[Si](C)(OCC)OC(C(C)C)C(C)C.
What is the InChIKey of 2,4-dimethylpentan-3-yloxy-ethenyl-ethoxy-methylsilane?
The InChIKey is IJUVCIUPPNTGFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2Si/c1-8-13-15(7,9-2)14-12(10(3)4)11(5)6/h9-12H,2,8H2,1,3-7H3.
What are the key properties of 2,4-dimethylpentan-3-yloxy-ethenyl-ethoxy-methylsilane?
2,4-dimethylpentan-3-yloxy-ethenyl-ethoxy-methylsilane has a molecular weight of 230.42 g/mol, XLogP of 3.52, 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-ethoxy-methylsilane is sourced from PubChem (CID 91730048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).