3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate

C11H22O4Si — CID 172555939

IUPAC3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate
SMILESC=CC(=O)OCCC[Si](C)(OC)OCCC
InChIInChI=1S/C11H22O4Si/c1-5-8-15-16(4,13-3)10-7-9-14-11(12)6-2/h6H,2,5,7-10H2,1,3-4H3
InChIKeyAHEGLKHZXUIROV-UHFFFAOYSA-N
MW246.38 g/mol
LogP2.25
Rot. Bonds9

About 3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate

3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate (PubChem CID 172555939) has the molecular formula C11H22O4Si and a molecular weight of 246.38 g/mol. Its IUPAC name is 3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate.

Molecular Properties

Compound Name3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate
PubChem CID172555939
Molecular FormulaC11H22O4Si
Molecular Weight246.38 g/mol
Exact Mass246.13
IUPAC Name3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate
SMILESC=CC(=O)OCCC[Si](C)(OC)OCCC
InChIInChI=1S/C11H22O4Si/c1-5-8-15-16(4,13-3)10-7-9-14-11(12)6-2/h6H,2,5,7-10H2,1,3-4H3
InChIKeyAHEGLKHZXUIROV-UHFFFAOYSA-N
XLogP2.25
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-[dibutoxy(methyl)silyl]propyl prop-2-enoate
CID 21432061
3-(methoxy-methyl-propoxysilyl)propyl but-2-enoate
CID 141003620
3-[dimethoxy(methyl)silyl]propyl prop-2-enoate;3-triethoxysilylpropyl prop-2-enoate
CID 87188845
3-[dimethoxy(methyl)silyl]propyl prop-2-enoate;3-trichlorosilylpropyl prop-2-enoate
CID 87857692
[dibutoxy(methyl)silyl]methyl 2-methylprop-2-enoate;3-[dimethoxy(methyl)silyl]propyl prop-2-enoate
CID 88604956
3-[dipropoxy(propyl)silyl]propyl prop-2-enoate
CID 21432072
3-[dimethoxy(propyl)silyl]propyl prop-2-enoate
CID 21432068
3-trimethoxysilylpropyl prop-2-enoate;hydrate
CID 141437630
3-[butoxy(dimethyl)silyl]propyl prop-2-enoate
CID 142550479
3-(ethoxy-methyl-propan-2-yloxysilyl)propyl prop-2-enoate
CID 140990688
3-[diethyl(methoxy)silyl]propyl prop-2-enoate
CID 18331018
3-[3-prop-2-enoyloxypropyl(dipropyl)silyl]propyl prop-2-enoate
CID 87228396

Frequently Asked Questions

What is the IUPAC name of 3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate?
The IUPAC name of 3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate (CID 172555939) is 3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate.
What is the SMILES notation for 3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate?
The canonical SMILES for 3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate is C=CC(=O)OCCC[Si](C)(OC)OCCC.
What is the InChIKey of 3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate?
The InChIKey is AHEGLKHZXUIROV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O4Si/c1-5-8-15-16(4,13-3)10-7-9-14-11(12)6-2/h6H,2,5,7-10H2,1,3-4H3.
What are the key properties of 3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate?
3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate has a molecular weight of 246.38 g/mol, XLogP of 2.25, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxy-methyl-propoxysilyl)propyl prop-2-enoate is sourced from PubChem (CID 172555939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).