ethoxyethane;1-trimethoxysilylbutyl prop-2-enoate

C14H30O6Si — CID 174844646

IUPACethoxyethane;1-trimethoxysilylbutyl prop-2-enoate
SMILESC=CC(=O)OC(CCC)[Si](OC)(OC)OC.CCOCC
InChIInChI=1S/C10H20O5Si.C4H10O/c1-6-8-10(15-9(11)7-2)16(12-3,13-4)14-5;1-3-5-4-2/h7,10H,2,6,8H2,1,3-5H3;3-4H2,1-2H3
InChIKeyIDDOIUWMMXSOJJ-UHFFFAOYSA-N
MW322.47 g/mol
LogP2.34
Rot. Bonds10

About ethoxyethane;1-trimethoxysilylbutyl prop-2-enoate

ethoxyethane;1-trimethoxysilylbutyl prop-2-enoate (PubChem CID 174844646) has the molecular formula C14H30O6Si and a molecular weight of 322.47 g/mol. Its IUPAC name is ethoxyethane;1-trimethoxysilylbutyl prop-2-enoate.

Molecular Properties

Compound Nameethoxyethane;1-trimethoxysilylbutyl prop-2-enoate
PubChem CID174844646
Molecular FormulaC14H30O6Si
Molecular Weight322.47 g/mol
Exact Mass322.18
IUPAC Nameethoxyethane;1-trimethoxysilylbutyl prop-2-enoate
SMILESC=CC(=O)OC(CCC)[Si](OC)(OC)OC.CCOCC
InChIInChI=1S/C10H20O5Si.C4H10O/c1-6-8-10(15-9(11)7-2)16(12-3,13-4)14-5;1-3-5-4-2/h7,10H,2,6,8H2,1,3-5H3;3-4H2,1-2H3
InChIKeyIDDOIUWMMXSOJJ-UHFFFAOYSA-N
XLogP2.34
TPSA63.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.47
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

1-trimethoxysilyldodecyl prop-2-enoate
CID 175341849
(3-methoxy-1-trimethoxysilylpropyl) prop-2-enoate
CID 174944570
ethoxyethane;1-hydroxypropyl prop-2-enoate
CID 174930262
1-fluoropentan-2-yl prop-2-enoate
CID 174661468
1-[[ethoxy(dimethyl)silyl]-bis[methoxy(dimethyl)silyl]silyl]propyl prop-2-enoate
CID 141421352
1-tri(propan-2-yloxy)silylpropyl prop-2-enoate
CID 87405020
1-[ethoxy-methoxy-[(1-oxo-2,4,5-trioxa-1λ5-phosphabicyclo[1.1.1]pentan-3-yl)oxy]silyl]propyl prop-2-enoate
CID 178069792
(1-chloro-2-ethoxyethyl) prop-2-enoate
CID 174760133
3-ethylheptan-4-yl prop-2-enoate
CID 123986793
1-prop-2-enoxypentan-2-yl prop-2-enoate
CID 171774459
1-tris[[ethenyl(dimethyl)silyl]oxy]silylpropyl prop-2-enoate
CID 87532765
1-hydroxybutyl prop-2-enoate;prop-2-en-1-ol
CID 88525550

Frequently Asked Questions

What is the IUPAC name of ethoxyethane;1-trimethoxysilylbutyl prop-2-enoate?
The IUPAC name of ethoxyethane;1-trimethoxysilylbutyl prop-2-enoate (CID 174844646) is ethoxyethane;1-trimethoxysilylbutyl prop-2-enoate.
What is the SMILES notation for ethoxyethane;1-trimethoxysilylbutyl prop-2-enoate?
The canonical SMILES for ethoxyethane;1-trimethoxysilylbutyl prop-2-enoate is C=CC(=O)OC(CCC)[Si](OC)(OC)OC.CCOCC.
What is the InChIKey of ethoxyethane;1-trimethoxysilylbutyl prop-2-enoate?
The InChIKey is IDDOIUWMMXSOJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O5Si.C4H10O/c1-6-8-10(15-9(11)7-2)16(12-3,13-4)14-5;1-3-5-4-2/h7,10H,2,6,8H2,1,3-5H3;3-4H2,1-2H3.
What are the key properties of ethoxyethane;1-trimethoxysilylbutyl prop-2-enoate?
ethoxyethane;1-trimethoxysilylbutyl prop-2-enoate has a molecular weight of 322.47 g/mol, XLogP of 2.34, 10 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxyethane;1-trimethoxysilylbutyl prop-2-enoate is sourced from PubChem (CID 174844646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).