[dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate

C9H18O6Si — CID 151222995

IUPAC[dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate
SMILESC=CC(=O)OCO[Si](CCOC)(OC)OC
InChIInChI=1S/C9H18O6Si/c1-5-9(10)14-8-15-16(12-3,13-4)7-6-11-2/h5H,1,6-8H2,2-4H3
InChIKeyNMRJMDNHCHVWNO-UHFFFAOYSA-N
MW250.32 g/mol
LogP0.57
Rot. Bonds9

About [dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate

[dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate (PubChem CID 151222995) has the molecular formula C9H18O6Si and a molecular weight of 250.32 g/mol. Its IUPAC name is [dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate.

Molecular Properties

Compound Name[dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate
PubChem CID151222995
Molecular FormulaC9H18O6Si
Molecular Weight250.32 g/mol
Exact Mass250.09
IUPAC Name[dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate
SMILESC=CC(=O)OCO[Si](CCOC)(OC)OC
InChIInChI=1S/C9H18O6Si/c1-5-9(10)14-8-15-16(12-3,13-4)7-6-11-2/h5H,1,6-8H2,2-4H3
InChIKeyNMRJMDNHCHVWNO-UHFFFAOYSA-N
XLogP0.57
TPSA63.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.32
LogP ≤ 50.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

[dimethoxy(propyl)silyl]oxymethyl prop-2-enoate
CID 87123617
2-[2-(2-trimethoxysilylethoxy)ethoxy]ethyl prop-2-enoate
CID 171586967
3-trimethoxysilylpropyl prop-2-enoate;hydrate
CID 141437630
phosphoric acid;3-trimethoxysilylpropyl prop-2-enoate
CID 174981814
3-[3-(2-trimethoxysilylethoxy)propoxy]propyl prop-2-enoate
CID 171586982
9-[ethoxy(dimethoxy)silyl]nonyl prop-2-enoate
CID 170945913
3-[[dimethoxy(3-prop-2-enoyloxypropyl)silyl]oxy-dimethoxysilyl]propyl prop-2-enoate
CID 18468769
2-[3-[ethoxy(dimethoxy)silyl]propoxy]ethyl prop-2-enoate
CID 141313483
4-methoxybutyl prop-2-enoate
CID 22321356
CID 166519746
CID 166519746
3-tris[[ethenyl(dimethoxy)silyl]oxy]silylpropyl prop-2-enoate
CID 142752557
(4-hydroxy-5-trimethoxysilylpentyl) prop-2-enoate
CID 88656819

Frequently Asked Questions

What is the IUPAC name of [dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate?
The IUPAC name of [dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate (CID 151222995) is [dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate.
What is the SMILES notation for [dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate?
The canonical SMILES for [dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate is C=CC(=O)OCO[Si](CCOC)(OC)OC.
What is the InChIKey of [dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate?
The InChIKey is NMRJMDNHCHVWNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O6Si/c1-5-9(10)14-8-15-16(12-3,13-4)7-6-11-2/h5H,1,6-8H2,2-4H3.
What are the key properties of [dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate?
[dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate has a molecular weight of 250.32 g/mol, XLogP of 0.57, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethoxy(2-methoxyethyl)silyl]oxymethyl prop-2-enoate is sourced from PubChem (CID 151222995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).