3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate

C12H24O2Si — CID 139977940

IUPAC3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[Si](C)(C)CCC
InChIInChI=1S/C12H24O2Si/c1-6-9-15(4,5)10-7-8-14-12(13)11(2)3/h2,6-10H2,1,3-5H3
InChIKeyDNMAHGRXMPIFGB-UHFFFAOYSA-N
MW228.41 g/mol
LogP3.61
Rot. Bonds7

About 3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate

3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate (PubChem CID 139977940) has the molecular formula C12H24O2Si and a molecular weight of 228.41 g/mol. Its IUPAC name is 3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate
PubChem CID139977940
Molecular FormulaC12H24O2Si
Molecular Weight228.41 g/mol
Exact Mass228.15
IUPAC Name3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCC[Si](C)(C)CCC
InChIInChI=1S/C12H24O2Si/c1-6-9-15(4,5)10-7-8-14-12(13)11(2)3/h2,6-10H2,1,3-5H3
InChIKeyDNMAHGRXMPIFGB-UHFFFAOYSA-N
XLogP3.61
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.41
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-[2-[methoxy(dimethyl)silyl]ethyl-dimethylsilyl]propyl 2-methylprop-2-enoate
CID 140912977
3-[3-[3-[2-(2-methoxyethoxy)ethoxy]propyl-dimethylsilyl]propyl-dimethylsilyl]propyl 2-methylprop-2-enoate
CID 139645621
3-[dipropyl(trimethylsilyloxy)silyl]propyl 2-methylprop-2-enoate
CID 18739228
3-[hydroxy(dimethyl)silyl]propyl 2-methylprop-2-enoate
CID 11009006
3-[[butyl(dimethyl)silyl]oxy-dimethylsilyl]propyl 2-methylprop-2-enoate
CID 22094222
butyl 2-methylprop-2-enoate;methane
CID 159646333
butyl 2-methylprop-2-enoate;λ2-stannane
CID 173448670
butyl 2-methylprop-2-enoate;ethene
CID 158758814
2-[hydroxy(dimethyl)silyl]ethyl 2-methylprop-2-enoate;3-[hydroxy(dimethyl)silyl]propyl 2-methylprop-2-enoate
CID 175909002
3-[2-[dimethyl-[3-(2-methylprop-2-enoyloxy)propyl]silyl]oxyethoxy-dimethylsilyl]propyl 2-methylprop-2-enoate
CID 156628189
azane;propyl 2-methylprop-2-enoate
CID 172812841
dodecyl 2-methylprop-2-enoate;propyl 2-methylprop-2-enoate
CID 87150170

Frequently Asked Questions

What is the IUPAC name of 3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate?
The IUPAC name of 3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate (CID 139977940) is 3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate.
What is the SMILES notation for 3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate?
The canonical SMILES for 3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate is C=C(C)C(=O)OCCC[Si](C)(C)CCC.
What is the InChIKey of 3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate?
The InChIKey is DNMAHGRXMPIFGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O2Si/c1-6-9-15(4,5)10-7-8-14-12(13)11(2)3/h2,6-10H2,1,3-5H3.
What are the key properties of 3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate?
3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate has a molecular weight of 228.41 g/mol, XLogP of 3.61, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[dimethyl(propyl)silyl]propyl 2-methylprop-2-enoate is sourced from PubChem (CID 139977940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).