1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate

C13H24O6Si — CID 66657431

IUPAC1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate
SMILESC=CC(=O)OC(CC)C1(OC)CCC[Si](OC)(OC)O1
InChIInChI=1S/C13H24O6Si/c1-6-11(18-12(14)7-2)13(15-3)9-8-10-20(16-4,17-5)19-13/h7,11H,2,6,8-10H2,1,3-5H3
InChIKeyGLSCGTAORIDYGE-UHFFFAOYSA-N
MW304.42 g/mol
LogP1.88
Rot. Bonds7

About 1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate

1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate (PubChem CID 66657431) has the molecular formula C13H24O6Si and a molecular weight of 304.42 g/mol. Its IUPAC name is 1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate.

Molecular Properties

Compound Name1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate
PubChem CID66657431
Molecular FormulaC13H24O6Si
Molecular Weight304.42 g/mol
Exact Mass304.13
IUPAC Name1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate
SMILESC=CC(=O)OC(CC)C1(OC)CCC[Si](OC)(OC)O1
InChIInChI=1S/C13H24O6Si/c1-6-11(18-12(14)7-2)13(15-3)9-8-10-20(16-4,17-5)19-13/h7,11H,2,6,8-10H2,1,3-5H3
InChIKeyGLSCGTAORIDYGE-UHFFFAOYSA-N
XLogP1.88
TPSA63.22 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 51.88
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'}

Analyze 1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(1-isocyanatopropyl)-2,2,6-trimethoxyoxasilinane
CID 87246800
[(1S)-1-hydroxypropyl] prop-2-enoate
CID 88739010
CID 172734708
CID 172734708
1-tris(trimethylsilyloxy)silylbutan-2-yl prop-2-enoate
CID 18949618
methyl prop-2-enoate;1,1,2-trimethoxy-2-propylsilinane
CID 175374557
1-prop-2-enoyloxypropyl but-2-enoate
CID 141048851
but-1-ene;methyl prop-2-eneperoxoate
CID 157272796
1-aminopropyl prop-2-enoate;butane
CID 87190109
1-(1,1,2-trimethoxy-3-methyl-2-propylsilinan-3-yl)prop-2-en-1-one
CID 174647401
1-(2-methyloxetan-2-yl)propan-2-yl prop-2-enoate
CID 141251975
CID 170564806
CID 170564806
1-dimethylsilyloxybutan-2-yl prop-2-enoate
CID 173371383

Frequently Asked Questions

What is the IUPAC name of 1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate?
The IUPAC name of 1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate (CID 66657431) is 1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate.
What is the SMILES notation for 1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate?
The canonical SMILES for 1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate is C=CC(=O)OC(CC)C1(OC)CCC[Si](OC)(OC)O1.
What is the InChIKey of 1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate?
The InChIKey is GLSCGTAORIDYGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O6Si/c1-6-11(18-12(14)7-2)13(15-3)9-8-10-20(16-4,17-5)19-13/h7,11H,2,6,8-10H2,1,3-5H3.
What are the key properties of 1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate?
1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate has a molecular weight of 304.42 g/mol, XLogP of 1.88, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2,6-trimethoxyoxasilinan-6-yl)propyl prop-2-enoate is sourced from PubChem (CID 66657431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).