cyclohexen-1-yl trimethyl silicate

C9H18O4Si — CID 11345004

IUPACcyclohexen-1-yl trimethyl silicate
SMILESCO[Si](OC)(OC)OC1=CCCCC1
InChIInChI=1S/C9H18O4Si/c1-10-14(11-2,12-3)13-9-7-5-4-6-8-9/h7H,4-6,8H2,1-3H3
InChIKeyQXTMYRKNZHTGRZ-UHFFFAOYSA-N
MW218.32 g/mol
LogP1.84
Rot. Bonds5

About cyclohexen-1-yl trimethyl silicate

cyclohexen-1-yl trimethyl silicate (PubChem CID 11345004) has the molecular formula C9H18O4Si and a molecular weight of 218.32 g/mol. Its IUPAC name is cyclohexen-1-yl trimethyl silicate.

Molecular Properties

Compound Namecyclohexen-1-yl trimethyl silicate
PubChem CID11345004
Molecular FormulaC9H18O4Si
Molecular Weight218.32 g/mol
Exact Mass218.10
IUPAC Namecyclohexen-1-yl trimethyl silicate
SMILESCO[Si](OC)(OC)OC1=CCCCC1
InChIInChI=1S/C9H18O4Si/c1-10-14(11-2,12-3)13-9-7-5-4-6-8-9/h7H,4-6,8H2,1-3H3
InChIKeyQXTMYRKNZHTGRZ-UHFFFAOYSA-N
XLogP1.84
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.32
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 cyclohexen-1-yl trimethyl silicate?
The IUPAC name of cyclohexen-1-yl trimethyl silicate (CID 11345004) is cyclohexen-1-yl trimethyl silicate.
What is the SMILES notation for cyclohexen-1-yl trimethyl silicate?
The canonical SMILES for cyclohexen-1-yl trimethyl silicate is CO[Si](OC)(OC)OC1=CCCCC1.
What is the InChIKey of cyclohexen-1-yl trimethyl silicate?
The InChIKey is QXTMYRKNZHTGRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O4Si/c1-10-14(11-2,12-3)13-9-7-5-4-6-8-9/h7H,4-6,8H2,1-3H3.
What are the key properties of cyclohexen-1-yl trimethyl silicate?
cyclohexen-1-yl trimethyl silicate has a molecular weight of 218.32 g/mol, XLogP of 1.84, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexen-1-yl trimethyl silicate is sourced from PubChem (CID 11345004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).