butan-2-yl triethyl silicate

C10H24O4Si — CID 87369711

IUPACbutan-2-yl triethyl silicate
SMILESCCO[Si](OCC)(OCC)OC(C)CC
InChIInChI=1S/C10H24O4Si/c1-6-10(5)14-15(11-7-2,12-8-3)13-9-4/h10H,6-9H2,1-5H3
InChIKeyZPMUCZBMDTXNNX-UHFFFAOYSA-N
MW236.38 g/mol
LogP2.35
Rot. Bonds9

About butan-2-yl triethyl silicate

butan-2-yl triethyl silicate (PubChem CID 87369711) has the molecular formula C10H24O4Si and a molecular weight of 236.38 g/mol. Its IUPAC name is butan-2-yl triethyl silicate.

Molecular Properties

Compound Namebutan-2-yl triethyl silicate
PubChem CID87369711
Molecular FormulaC10H24O4Si
Molecular Weight236.38 g/mol
Exact Mass236.14
IUPAC Namebutan-2-yl triethyl silicate
SMILESCCO[Si](OCC)(OCC)OC(C)CC
InChIInChI=1S/C10H24O4Si/c1-6-10(5)14-15(11-7-2,12-8-3)13-9-4/h10H,6-9H2,1-5H3
InChIKeyZPMUCZBMDTXNNX-UHFFFAOYSA-N
XLogP2.35
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.38
LogP ≤ 52.35
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 butan-2-yl triethyl silicate?
The IUPAC name of butan-2-yl triethyl silicate (CID 87369711) is butan-2-yl triethyl silicate.
What is the SMILES notation for butan-2-yl triethyl silicate?
The canonical SMILES for butan-2-yl triethyl silicate is CCO[Si](OCC)(OCC)OC(C)CC.
What is the InChIKey of butan-2-yl triethyl silicate?
The InChIKey is ZPMUCZBMDTXNNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24O4Si/c1-6-10(5)14-15(11-7-2,12-8-3)13-9-4/h10H,6-9H2,1-5H3.
What are the key properties of butan-2-yl triethyl silicate?
butan-2-yl triethyl silicate has a molecular weight of 236.38 g/mol, XLogP of 2.35, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for butan-2-yl triethyl silicate is sourced from PubChem (CID 87369711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).