2,2-dimethoxyhex-5-enoxysilane

C8H18O3Si — CID 123195271

IUPAC2,2-dimethoxyhex-5-enoxysilane
SMILESC=CCCC(CO[SiH3])(OC)OC
InChIInChI=1S/C8H18O3Si/c1-4-5-6-8(9-2,10-3)7-11-12/h4H,1,5-7H2,2-3,12H3
InChIKeyQFOVPXBAPNKMGH-UHFFFAOYSA-N
MW190.31 g/mol
LogP0.24
Rot. Bonds7

About 2,2-dimethoxyhex-5-enoxysilane

2,2-dimethoxyhex-5-enoxysilane (PubChem CID 123195271) has the molecular formula C8H18O3Si and a molecular weight of 190.31 g/mol. Its IUPAC name is 2,2-dimethoxyhex-5-enoxysilane.

Molecular Properties

Compound Name2,2-dimethoxyhex-5-enoxysilane
PubChem CID123195271
Molecular FormulaC8H18O3Si
Molecular Weight190.31 g/mol
Exact Mass190.10
IUPAC Name2,2-dimethoxyhex-5-enoxysilane
SMILESC=CCCC(CO[SiH3])(OC)OC
InChIInChI=1S/C8H18O3Si/c1-4-5-6-8(9-2,10-3)7-11-12/h4H,1,5-7H2,2-3,12H3
InChIKeyQFOVPXBAPNKMGH-UHFFFAOYSA-N
XLogP0.24
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.31
LogP ≤ 50.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethoxyhex-5-enoxysilane?
The IUPAC name of 2,2-dimethoxyhex-5-enoxysilane (CID 123195271) is 2,2-dimethoxyhex-5-enoxysilane.
What is the SMILES notation for 2,2-dimethoxyhex-5-enoxysilane?
The canonical SMILES for 2,2-dimethoxyhex-5-enoxysilane is C=CCCC(CO[SiH3])(OC)OC.
What is the InChIKey of 2,2-dimethoxyhex-5-enoxysilane?
The InChIKey is QFOVPXBAPNKMGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O3Si/c1-4-5-6-8(9-2,10-3)7-11-12/h4H,1,5-7H2,2-3,12H3.
What are the key properties of 2,2-dimethoxyhex-5-enoxysilane?
2,2-dimethoxyhex-5-enoxysilane has a molecular weight of 190.31 g/mol, XLogP of 0.24, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethoxyhex-5-enoxysilane is sourced from PubChem (CID 123195271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).