chloroform;tetraethyl silicate

C9H21Cl3O4Si — CID 158130074

IUPACchloroform;tetraethyl silicate
SMILESCCO[Si](OCC)(OCC)OCC.ClC(Cl)Cl
InChIInChI=1S/C8H20O4Si.CHCl3/c1-5-9-13(10-6-2,11-7-3)12-8-4;2-1(3)4/h5-8H2,1-4H3;1H
InChIKeyFSQYMFYATLBCQM-UHFFFAOYSA-N
MW327.71 g/mol
LogP3.55
Rot. Bonds8

About chloroform;tetraethyl silicate

chloroform;tetraethyl silicate (PubChem CID 158130074) has the molecular formula C9H21Cl3O4Si and a molecular weight of 327.71 g/mol. Its IUPAC name is chloroform;tetraethyl silicate.

Molecular Properties

Compound Namechloroform;tetraethyl silicate
PubChem CID158130074
Molecular FormulaC9H21Cl3O4Si
Molecular Weight327.71 g/mol
Exact Mass326.03
IUPAC Namechloroform;tetraethyl silicate
SMILESCCO[Si](OCC)(OCC)OCC.ClC(Cl)Cl
InChIInChI=1S/C8H20O4Si.CHCl3/c1-5-9-13(10-6-2,11-7-3)12-8-4;2-1(3)4/h5-8H2,1-4H3;1H
InChIKeyFSQYMFYATLBCQM-UHFFFAOYSA-N
XLogP3.55
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.71
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloroform;tetraethyl silicate?
The IUPAC name of chloroform;tetraethyl silicate (CID 158130074) is chloroform;tetraethyl silicate.
What is the SMILES notation for chloroform;tetraethyl silicate?
The canonical SMILES for chloroform;tetraethyl silicate is CCO[Si](OCC)(OCC)OCC.ClC(Cl)Cl.
What is the InChIKey of chloroform;tetraethyl silicate?
The InChIKey is FSQYMFYATLBCQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20O4Si.CHCl3/c1-5-9-13(10-6-2,11-7-3)12-8-4;2-1(3)4/h5-8H2,1-4H3;1H.
What are the key properties of chloroform;tetraethyl silicate?
chloroform;tetraethyl silicate has a molecular weight of 327.71 g/mol, XLogP of 3.55, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for chloroform;tetraethyl silicate is sourced from PubChem (CID 158130074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).