[methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate

C18H20O3Si — CID 66629625

IUPAC[methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC[Si](OC)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H20O3Si/c1-15(2)18(19)21-14-22(20-3,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,1,14H2,2-3H3
InChIKeyNPIYOLADWBBKDA-UHFFFAOYSA-N
MW312.44 g/mol
LogP2.05
Rot. Bonds6

About [methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate

[methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate (PubChem CID 66629625) has the molecular formula C18H20O3Si and a molecular weight of 312.44 g/mol. Its IUPAC name is [methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name[methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate
PubChem CID66629625
Molecular FormulaC18H20O3Si
Molecular Weight312.44 g/mol
Exact Mass312.12
IUPAC Name[methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC[Si](OC)(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H20O3Si/c1-15(2)18(19)21-14-22(20-3,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,1,14H2,2-3H3
InChIKeyNPIYOLADWBBKDA-UHFFFAOYSA-N
XLogP2.05
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.44
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[dimethoxy(phenyl)silyl]methyl 2-methylprop-2-enoate
CID 66629429
(aminomethyl-methyl-phenylsilyl)methyl 2-methylprop-2-enoate
CID 151665095
2-triphenylsilylsulfanylethyl 2-methylprop-2-enoate
CID 102034522
3-[bis[[dimethyl(phenyl)silyl]oxy]-methoxysilyl]propyl 2-methylprop-2-enoate
CID 66675453
benzyl 2-methyl(113C)prop-2-enoate;benzyl 2-oxo(113C)propanoate
CID 161249019
3-[hydroxy-methoxy-[methoxy(diphenyl)silyl]oxysilyl]propyl 2-methylprop-2-enoate
CID 102349948
benzyl 2-methylprop-2-enoate;hydrofluoride
CID 161313656
2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;toluene
CID 163489883
2-[dimethoxy(phenoxy)silyl]ethyl 2-methylprop-2-enoate
CID 139977872
2-phenylpropan-2-yl 2-methylprop-2-enoate;trimethylsilylmethyl 2-methylprop-2-enoate
CID 86753510
3-[dimethyl-[methyl(diphenyl)silyl]oxysilyl]propyl 2-methylprop-2-enoate
CID 54512859
3-[diethoxy(phenyl)silyl]propyl 2-methylprop-2-enoate
CID 19012650

Frequently Asked Questions

What is the IUPAC name of [methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate?
The IUPAC name of [methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate (CID 66629625) is [methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate.
What is the SMILES notation for [methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate?
The canonical SMILES for [methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate is C=C(C)C(=O)OC[Si](OC)(c1ccccc1)c1ccccc1.
What is the InChIKey of [methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate?
The InChIKey is NPIYOLADWBBKDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O3Si/c1-15(2)18(19)21-14-22(20-3,16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13H,1,14H2,2-3H3.
What are the key properties of [methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate?
[methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate has a molecular weight of 312.44 g/mol, XLogP of 2.05, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [methoxy(diphenyl)silyl]methyl 2-methylprop-2-enoate is sourced from PubChem (CID 66629625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).