triethoxy [ethyl(propan-2-yl)amino] silicate

C11H27NO7Si — CID 175300116

IUPACtriethoxy [ethyl(propan-2-yl)amino] silicate
SMILESCCOO[Si](OOCC)(OOCC)ON(CC)C(C)C
InChIInChI=1S/C11H27NO7Si/c1-7-12(11(5)6)16-20(17-13-8-2,18-14-9-3)19-15-10-4/h11H,7-10H2,1-6H3
InChIKeyJIKCOVCLUREMBB-UHFFFAOYSA-N
MW313.42 g/mol
LogP1.99
Rot. Bonds13

About triethoxy [ethyl(propan-2-yl)amino] silicate

triethoxy [ethyl(propan-2-yl)amino] silicate (PubChem CID 175300116) has the molecular formula C11H27NO7Si and a molecular weight of 313.42 g/mol. Its IUPAC name is triethoxy [ethyl(propan-2-yl)amino] silicate.

Molecular Properties

Compound Nametriethoxy [ethyl(propan-2-yl)amino] silicate
PubChem CID175300116
Molecular FormulaC11H27NO7Si
Molecular Weight313.42 g/mol
Exact Mass313.16
IUPAC Nametriethoxy [ethyl(propan-2-yl)amino] silicate
SMILESCCOO[Si](OOCC)(OOCC)ON(CC)C(C)C
InChIInChI=1S/C11H27NO7Si/c1-7-12(11(5)6)16-20(17-13-8-2,18-14-9-3)19-15-10-4/h11H,7-10H2,1-6H3
InChIKeyJIKCOVCLUREMBB-UHFFFAOYSA-N
XLogP1.99
TPSA67.85 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.42
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of triethoxy [ethyl(propan-2-yl)amino] silicate?
The IUPAC name of triethoxy [ethyl(propan-2-yl)amino] silicate (CID 175300116) is triethoxy [ethyl(propan-2-yl)amino] silicate.
What is the SMILES notation for triethoxy [ethyl(propan-2-yl)amino] silicate?
The canonical SMILES for triethoxy [ethyl(propan-2-yl)amino] silicate is CCOO[Si](OOCC)(OOCC)ON(CC)C(C)C.
What is the InChIKey of triethoxy [ethyl(propan-2-yl)amino] silicate?
The InChIKey is JIKCOVCLUREMBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27NO7Si/c1-7-12(11(5)6)16-20(17-13-8-2,18-14-9-3)19-15-10-4/h11H,7-10H2,1-6H3.
What are the key properties of triethoxy [ethyl(propan-2-yl)amino] silicate?
triethoxy [ethyl(propan-2-yl)amino] silicate has a molecular weight of 313.42 g/mol, XLogP of 1.99, 13 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy [ethyl(propan-2-yl)amino] silicate is sourced from PubChem (CID 175300116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).