[4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate

C19H34O5Si — CID 173329049

IUPAC[4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCCC(CCCOC(=O)C(=C)C)C(CCC)O[SiH3]
InChIInChI=1S/C19H34O5Si/c1-6-9-17(24-25)16(10-7-12-22-18(20)14(2)3)11-8-13-23-19(21)15(4)5/h16-17H,2,4,6-13H2,1,3,5,25H3
InChIKeyGGDCKNZTJBJDAB-UHFFFAOYSA-N
MW370.56 g/mol
LogP2.87
Rot. Bonds14

About [4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate

[4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate (PubChem CID 173329049) has the molecular formula C19H34O5Si and a molecular weight of 370.56 g/mol. Its IUPAC name is [4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate.

Molecular Properties

Compound Name[4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate
PubChem CID173329049
Molecular FormulaC19H34O5Si
Molecular Weight370.56 g/mol
Exact Mass370.22
IUPAC Name[4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCCC(CCCOC(=O)C(=C)C)C(CCC)O[SiH3]
InChIInChI=1S/C19H34O5Si/c1-6-9-17(24-25)16(10-7-12-22-18(20)14(2)3)11-8-13-23-19(21)15(4)5/h16-17H,2,4,6-13H2,1,3,5,25H3
InChIKeyGGDCKNZTJBJDAB-UHFFFAOYSA-N
XLogP2.87
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds14
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.56
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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

4-ethyloctyl 2-methylprop-2-enoate
CID 57022473
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
4-(2-silyloxypropan-2-yl)octyl 2-methylprop-2-enoate
CID 173068945
[5-(prop-2-enoyloxymethyl)-4-propylheptyl] 2-methylprop-2-enoate
CID 57254478
butyl 2-methylprop-2-enoate;ethoxysilane;propyl 2-methylprop-2-enoate
CID 175326271
dodecyl 2-methylprop-2-enoate;hexadecyl 2-methylprop-2-enoate;icosyl 2-methylprop-2-enoate;octadecyl 2-methylprop-2-enoate;tetradecyl 2-methylprop-2-enoate
CID 170851547
octatetracontyl 2-methylprop-2-enoate
CID 141233444
decyl 2-methylprop-2-enoate;dodecyl 2-methylprop-2-enoate;hexadecyl 2-methylprop-2-enoate;pentadecyl 2-methylprop-2-enoate;tetradecyl 2-methylprop-2-enoate;tridecyl 2-methylprop-2-enoate;undecyl 2-methylprop-2-enoate
CID 164995054
decyl 2-methylprop-2-enoate;dodecyl 2-methylprop-2-enoate;heptadecyl 2-methylprop-2-enoate;hexadecyl 2-methylprop-2-enoate;nonadecyl 2-methylprop-2-enoate;nonyl 2-methylprop-2-enoate;octadecyl 2-methylprop-2-enoate;pentadecyl 2-methylprop-2-enoate;tetradecyl 2-methylprop-2-enoate;tridecyl 2-methylprop-2-enoate;undecyl 2-methylprop-2-enoate
CID 161498189
8-propyltetradecyl 2-methylprop-2-enoate
CID 156690480

Frequently Asked Questions

What is the IUPAC name of [4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate?
The IUPAC name of [4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate (CID 173329049) is [4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate.
What is the SMILES notation for [4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate?
The canonical SMILES for [4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate is C=C(C)C(=O)OCCCC(CCCOC(=O)C(=C)C)C(CCC)O[SiH3].
What is the InChIKey of [4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate?
The InChIKey is GGDCKNZTJBJDAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34O5Si/c1-6-9-17(24-25)16(10-7-12-22-18(20)14(2)3)11-8-13-23-19(21)15(4)5/h16-17H,2,4,6-13H2,1,3,5,25H3.
What are the key properties of [4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate?
[4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate has a molecular weight of 370.56 g/mol, XLogP of 2.87, 14 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[3-(2-methylprop-2-enoyloxy)propyl]-5-silyloxyoctyl] 2-methylprop-2-enoate is sourced from PubChem (CID 173329049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).