butyl trimethyl silicate

C7H18O4Si — CID 524709

IUPACbutyl trimethyl silicate
SMILESCCCCO[Si](OC)(OC)OC
InChIInChI=1S/C7H18O4Si/c1-5-6-7-11-12(8-2,9-3)10-4/h5-7H2,1-4H3
InChIKeyGPLARHNOLLDPGA-UHFFFAOYSA-N
MW194.30 g/mol
LogP1.18
Rot. Bonds7

About butyl trimethyl silicate

butyl trimethyl silicate (PubChem CID 524709) has the molecular formula C7H18O4Si and a molecular weight of 194.30 g/mol. Its IUPAC name is butyl trimethyl silicate.

Molecular Properties

Compound Namebutyl trimethyl silicate
PubChem CID524709
Molecular FormulaC7H18O4Si
Molecular Weight194.30 g/mol
Exact Mass194.10
IUPAC Namebutyl trimethyl silicate
SMILESCCCCO[Si](OC)(OC)OC
InChIInChI=1S/C7H18O4Si/c1-5-6-7-11-12(8-2,9-3)10-4/h5-7H2,1-4H3
InChIKeyGPLARHNOLLDPGA-UHFFFAOYSA-N
XLogP1.18
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.30
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of butyl trimethyl silicate?
The IUPAC name of butyl trimethyl silicate (CID 524709) is butyl trimethyl silicate.
What is the SMILES notation for butyl trimethyl silicate?
The canonical SMILES for butyl trimethyl silicate is CCCCO[Si](OC)(OC)OC.
What is the InChIKey of butyl trimethyl silicate?
The InChIKey is GPLARHNOLLDPGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18O4Si/c1-5-6-7-11-12(8-2,9-3)10-4/h5-7H2,1-4H3.
What are the key properties of butyl trimethyl silicate?
butyl trimethyl silicate has a molecular weight of 194.30 g/mol, XLogP of 1.18, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for butyl trimethyl silicate is sourced from PubChem (CID 524709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).