tripropoxysilylmethyl 2-methylprop-2-enoate

C14H28O5Si — CID 22266632

IUPACtripropoxysilylmethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC[Si](OCCC)(OCCC)OCCC
InChIInChI=1S/C14H28O5Si/c1-6-9-17-20(18-10-7-2,19-11-8-3)12-16-14(15)13(4)5/h4,6-12H2,1-3,5H3
InChIKeyQYTRLLRHSKCMOP-UHFFFAOYSA-N
MW304.46 g/mol
LogP2.86
Rot. Bonds12

About tripropoxysilylmethyl 2-methylprop-2-enoate

tripropoxysilylmethyl 2-methylprop-2-enoate (PubChem CID 22266632) has the molecular formula C14H28O5Si and a molecular weight of 304.46 g/mol. Its IUPAC name is tripropoxysilylmethyl 2-methylprop-2-enoate.

Molecular Properties

Compound Nametripropoxysilylmethyl 2-methylprop-2-enoate
PubChem CID22266632
Molecular FormulaC14H28O5Si
Molecular Weight304.46 g/mol
Exact Mass304.17
IUPAC Nametripropoxysilylmethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC[Si](OCCC)(OCCC)OCCC
InChIInChI=1S/C14H28O5Si/c1-6-9-17-20(18-10-7-2,19-11-8-3)12-16-14(15)13(4)5/h4,6-12H2,1-3,5H3
InChIKeyQYTRLLRHSKCMOP-UHFFFAOYSA-N
XLogP2.86
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.46
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tripropoxysilylmethyl 2-methylprop-2-enoate?
The IUPAC name of tripropoxysilylmethyl 2-methylprop-2-enoate (CID 22266632) is tripropoxysilylmethyl 2-methylprop-2-enoate.
What is the SMILES notation for tripropoxysilylmethyl 2-methylprop-2-enoate?
The canonical SMILES for tripropoxysilylmethyl 2-methylprop-2-enoate is C=C(C)C(=O)OC[Si](OCCC)(OCCC)OCCC.
What is the InChIKey of tripropoxysilylmethyl 2-methylprop-2-enoate?
The InChIKey is QYTRLLRHSKCMOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O5Si/c1-6-9-17-20(18-10-7-2,19-11-8-3)12-16-14(15)13(4)5/h4,6-12H2,1-3,5H3.
What are the key properties of tripropoxysilylmethyl 2-methylprop-2-enoate?
tripropoxysilylmethyl 2-methylprop-2-enoate has a molecular weight of 304.46 g/mol, XLogP of 2.86, 12 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tripropoxysilylmethyl 2-methylprop-2-enoate is sourced from PubChem (CID 22266632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).