(methoxy-methylsilyloxy-propylsilyl) prop-2-enoate

C8H18O4Si2 — CID 123229443

IUPAC(methoxy-methylsilyloxy-propylsilyl) prop-2-enoate
SMILESC=CC(=O)O[Si](CCC)(OC)O[SiH2]C
InChIInChI=1S/C8H18O4Si2/c1-5-7-14(10-3,12-13-4)11-8(9)6-2/h6H,2,5,7,13H2,1,3-4H3
InChIKeyXVLPLBMNIFUEGZ-UHFFFAOYSA-N
MW234.40 g/mol
LogP0.86
Rot. Bonds7

About (methoxy-methylsilyloxy-propylsilyl) prop-2-enoate

(methoxy-methylsilyloxy-propylsilyl) prop-2-enoate (PubChem CID 123229443) has the molecular formula C8H18O4Si2 and a molecular weight of 234.40 g/mol. Its IUPAC name is (methoxy-methylsilyloxy-propylsilyl) prop-2-enoate.

Molecular Properties

Compound Name(methoxy-methylsilyloxy-propylsilyl) prop-2-enoate
PubChem CID123229443
Molecular FormulaC8H18O4Si2
Molecular Weight234.40 g/mol
Exact Mass234.07
IUPAC Name(methoxy-methylsilyloxy-propylsilyl) prop-2-enoate
SMILESC=CC(=O)O[Si](CCC)(OC)O[SiH2]C
InChIInChI=1S/C8H18O4Si2/c1-5-7-14(10-3,12-13-4)11-8(9)6-2/h6H,2,5,7,13H2,1,3-4H3
InChIKeyXVLPLBMNIFUEGZ-UHFFFAOYSA-N
XLogP0.86
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.40
LogP ≤ 50.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 (methoxy-methylsilyloxy-propylsilyl) prop-2-enoate?
The IUPAC name of (methoxy-methylsilyloxy-propylsilyl) prop-2-enoate (CID 123229443) is (methoxy-methylsilyloxy-propylsilyl) prop-2-enoate.
What is the SMILES notation for (methoxy-methylsilyloxy-propylsilyl) prop-2-enoate?
The canonical SMILES for (methoxy-methylsilyloxy-propylsilyl) prop-2-enoate is C=CC(=O)O[Si](CCC)(OC)O[SiH2]C.
What is the InChIKey of (methoxy-methylsilyloxy-propylsilyl) prop-2-enoate?
The InChIKey is XVLPLBMNIFUEGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O4Si2/c1-5-7-14(10-3,12-13-4)11-8(9)6-2/h6H,2,5,7,13H2,1,3-4H3.
What are the key properties of (methoxy-methylsilyloxy-propylsilyl) prop-2-enoate?
(methoxy-methylsilyloxy-propylsilyl) prop-2-enoate has a molecular weight of 234.40 g/mol, XLogP of 0.86, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (methoxy-methylsilyloxy-propylsilyl) prop-2-enoate is sourced from PubChem (CID 123229443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).