di(cyclohexen-1-yl)-dipropoxysilane

C18H32O2Si — CID 66598945

IUPACdi(cyclohexen-1-yl)-dipropoxysilane
SMILESCCCO[Si](OCCC)(C1=CCCCC1)C1=CCCCC1
InChIInChI=1S/C18H32O2Si/c1-3-15-19-21(20-16-4-2,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h11,13H,3-10,12,14-16H2,1-2H3
InChIKeyKYUZXOHECBCYSE-UHFFFAOYSA-N
MW308.54 g/mol
LogP5.36
Rot. Bonds8

About di(cyclohexen-1-yl)-dipropoxysilane

di(cyclohexen-1-yl)-dipropoxysilane (PubChem CID 66598945) has the molecular formula C18H32O2Si and a molecular weight of 308.54 g/mol. Its IUPAC name is di(cyclohexen-1-yl)-dipropoxysilane.

Molecular Properties

Compound Namedi(cyclohexen-1-yl)-dipropoxysilane
PubChem CID66598945
Molecular FormulaC18H32O2Si
Molecular Weight308.54 g/mol
Exact Mass308.22
IUPAC Namedi(cyclohexen-1-yl)-dipropoxysilane
SMILESCCCO[Si](OCCC)(C1=CCCCC1)C1=CCCCC1
InChIInChI=1S/C18H32O2Si/c1-3-15-19-21(20-16-4-2,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h11,13H,3-10,12,14-16H2,1-2H3
InChIKeyKYUZXOHECBCYSE-UHFFFAOYSA-N
XLogP5.36
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.54
LogP ≤ 55.36
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 di(cyclohexen-1-yl)-dipropoxysilane?
The IUPAC name of di(cyclohexen-1-yl)-dipropoxysilane (CID 66598945) is di(cyclohexen-1-yl)-dipropoxysilane.
What is the SMILES notation for di(cyclohexen-1-yl)-dipropoxysilane?
The canonical SMILES for di(cyclohexen-1-yl)-dipropoxysilane is CCCO[Si](OCCC)(C1=CCCCC1)C1=CCCCC1.
What is the InChIKey of di(cyclohexen-1-yl)-dipropoxysilane?
The InChIKey is KYUZXOHECBCYSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32O2Si/c1-3-15-19-21(20-16-4-2,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h11,13H,3-10,12,14-16H2,1-2H3.
What are the key properties of di(cyclohexen-1-yl)-dipropoxysilane?
di(cyclohexen-1-yl)-dipropoxysilane has a molecular weight of 308.54 g/mol, XLogP of 5.36, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for di(cyclohexen-1-yl)-dipropoxysilane is sourced from PubChem (CID 66598945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).