3-cycloheptylprop-2-enoxy(diethoxy)silane

C14H28O3Si — CID 154099248

IUPAC3-cycloheptylprop-2-enoxy(diethoxy)silane
SMILESCCO[SiH](OCC)OCC=CC1CCCCCC1
InChIInChI=1S/C14H28O3Si/c1-3-15-18(16-4-2)17-13-9-12-14-10-7-5-6-8-11-14/h9,12,14,18H,3-8,10-11,13H2,1-2H3
InChIKeyMALZOVAYMSJNAE-UHFFFAOYSA-N
MW272.46 g/mol
LogP3.32
Rot. Bonds8

About 3-cycloheptylprop-2-enoxy(diethoxy)silane

3-cycloheptylprop-2-enoxy(diethoxy)silane (PubChem CID 154099248) has the molecular formula C14H28O3Si and a molecular weight of 272.46 g/mol. Its IUPAC name is 3-cycloheptylprop-2-enoxy(diethoxy)silane.

Molecular Properties

Compound Name3-cycloheptylprop-2-enoxy(diethoxy)silane
PubChem CID154099248
Molecular FormulaC14H28O3Si
Molecular Weight272.46 g/mol
Exact Mass272.18
IUPAC Name3-cycloheptylprop-2-enoxy(diethoxy)silane
SMILESCCO[SiH](OCC)OCC=CC1CCCCCC1
InChIInChI=1S/C14H28O3Si/c1-3-15-18(16-4-2)17-13-9-12-14-10-7-5-6-8-11-14/h9,12,14,18H,3-8,10-11,13H2,1-2H3
InChIKeyMALZOVAYMSJNAE-UHFFFAOYSA-N
XLogP3.32
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.46
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-cycloheptylprop-2-enoxy-cyclohexyl-ethoxysilane
CID 154107886
[(E)-but-1-enyl]cyclodecane
CID 173272598
CID 68792381
CID 68792381
3-cyclohexylprop-2-enyl hydrogen carbonate
CID 139900277
cyclopropanethiol;triethoxysilane
CID 175391006
cyclopropanamine;triethoxysilane
CID 173155848
3-cyclohexylprop-2-ene-1-thiol
CID 54572501
2-cyclohexylethenylcyclohexane
CID 4124459
azepane;triethoxysilane
CID 173012109
cyclohexyl-cyclopentyl-ethoxysilane
CID 151835803
cyclohexanecarbaldehyde;ethyl formate
CID 175526920
3-cyclopentylprop-2-en-1-amine
CID 54310760

Frequently Asked Questions

What is the IUPAC name of 3-cycloheptylprop-2-enoxy(diethoxy)silane?
The IUPAC name of 3-cycloheptylprop-2-enoxy(diethoxy)silane (CID 154099248) is 3-cycloheptylprop-2-enoxy(diethoxy)silane.
What is the SMILES notation for 3-cycloheptylprop-2-enoxy(diethoxy)silane?
The canonical SMILES for 3-cycloheptylprop-2-enoxy(diethoxy)silane is CCO[SiH](OCC)OCC=CC1CCCCCC1.
What is the InChIKey of 3-cycloheptylprop-2-enoxy(diethoxy)silane?
The InChIKey is MALZOVAYMSJNAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O3Si/c1-3-15-18(16-4-2)17-13-9-12-14-10-7-5-6-8-11-14/h9,12,14,18H,3-8,10-11,13H2,1-2H3.
What are the key properties of 3-cycloheptylprop-2-enoxy(diethoxy)silane?
3-cycloheptylprop-2-enoxy(diethoxy)silane has a molecular weight of 272.46 g/mol, XLogP of 3.32, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cycloheptylprop-2-enoxy(diethoxy)silane is sourced from PubChem (CID 154099248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).