triethyl (3-ethyloxetan-3-yl)methyl silicate

C12H26O5Si — CID 20805382

IUPACtriethyl (3-ethyloxetan-3-yl)methyl silicate
SMILESCCO[Si](OCC)(OCC)OCC1(CC)COC1
InChIInChI=1S/C12H26O5Si/c1-5-12(9-13-10-12)11-17-18(14-6-2,15-7-3)16-8-4/h5-11H2,1-4H3
InChIKeyBBXWTUAWOKXXJE-UHFFFAOYSA-N
MW278.42 g/mol
LogP1.97
Rot. Bonds10

About triethyl (3-ethyloxetan-3-yl)methyl silicate

triethyl (3-ethyloxetan-3-yl)methyl silicate (PubChem CID 20805382) has the molecular formula C12H26O5Si and a molecular weight of 278.42 g/mol. Its IUPAC name is triethyl (3-ethyloxetan-3-yl)methyl silicate.

Molecular Properties

Compound Nametriethyl (3-ethyloxetan-3-yl)methyl silicate
PubChem CID20805382
Molecular FormulaC12H26O5Si
Molecular Weight278.42 g/mol
Exact Mass278.15
IUPAC Nametriethyl (3-ethyloxetan-3-yl)methyl silicate
SMILESCCO[Si](OCC)(OCC)OCC1(CC)COC1
InChIInChI=1S/C12H26O5Si/c1-5-12(9-13-10-12)11-17-18(14-6-2,15-7-3)16-8-4/h5-11H2,1-4H3
InChIKeyBBXWTUAWOKXXJE-UHFFFAOYSA-N
XLogP1.97
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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 triethyl (3-ethyloxetan-3-yl)methyl silicate?
The IUPAC name of triethyl (3-ethyloxetan-3-yl)methyl silicate (CID 20805382) is triethyl (3-ethyloxetan-3-yl)methyl silicate.
What is the SMILES notation for triethyl (3-ethyloxetan-3-yl)methyl silicate?
The canonical SMILES for triethyl (3-ethyloxetan-3-yl)methyl silicate is CCO[Si](OCC)(OCC)OCC1(CC)COC1.
What is the InChIKey of triethyl (3-ethyloxetan-3-yl)methyl silicate?
The InChIKey is BBXWTUAWOKXXJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O5Si/c1-5-12(9-13-10-12)11-17-18(14-6-2,15-7-3)16-8-4/h5-11H2,1-4H3.
What are the key properties of triethyl (3-ethyloxetan-3-yl)methyl silicate?
triethyl (3-ethyloxetan-3-yl)methyl silicate has a molecular weight of 278.42 g/mol, XLogP of 1.97, 10 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl (3-ethyloxetan-3-yl)methyl silicate is sourced from PubChem (CID 20805382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).