2-methylprop-2-enoate;tributylsilanylium

C16H34O2Si — CID 159425085

IUPAC2-methylprop-2-enoate;tributylsilanylium
SMILESC=C(C)C(=O)[O-].CCCC[SiH2+](CCCC)CCCC
InChIInChI=1S/C12H29Si.C4H6O2/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-3(2)4(5)6/h4-13H2,1-3H3;1H2,2H3,(H,5,6)/q+1;/p-1
InChIKeyWUKVMQSNYJWAMV-UHFFFAOYSA-M
MW286.53 g/mol
LogP3.66
Rot. Bonds10

About 2-methylprop-2-enoate;tributylsilanylium

2-methylprop-2-enoate;tributylsilanylium (PubChem CID 159425085) has the molecular formula C16H34O2Si and a molecular weight of 286.53 g/mol. Its IUPAC name is 2-methylprop-2-enoate;tributylsilanylium.

Molecular Properties

Compound Name2-methylprop-2-enoate;tributylsilanylium
PubChem CID159425085
Molecular FormulaC16H34O2Si
Molecular Weight286.53 g/mol
Exact Mass286.23
IUPAC Name2-methylprop-2-enoate;tributylsilanylium
SMILESC=C(C)C(=O)[O-].CCCC[SiH2+](CCCC)CCCC
InChIInChI=1S/C12H29Si.C4H6O2/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-3(2)4(5)6/h4-13H2,1-3H3;1H2,2H3,(H,5,6)/q+1;/p-1
InChIKeyWUKVMQSNYJWAMV-UHFFFAOYSA-M
XLogP3.66
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.53
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

2-methylprop-2-enoate
CID 19005746
butyl(triethyl)azanium;2-methylprop-2-enoate
CID 139889730
copper;dodecanoate;2-methylprop-2-enoate
CID 130339555
hexakis(2-methylprop-2-enoate);molybdenum
CID 173015670
gadolinium(3+);tris(2-methylprop-2-enoate)
CID 162156326
bis(2-methylprop-2-enoate);samarium
CID 175299700
hexadecyl 2-methylprop-2-enoate;2-methylprop-2-enoate
CID 19816604
dodecan-1-olate;2-methylprop-2-enoate;propan-2-olate;tetradecan-1-olate;titanium(4+)
CID 170845189
bis(2-methylprop-2-enoate);prop-2-enoate;tris(tributylstannanylium)
CID 173422883
sodium;ethene;2-methylprop-2-enoate
CID 23688925
chromium(3+);2-methylprop-2-enoate;chloride
CID 19738661
calcium;2-methylprop-2-enoate;chloride
CID 174912380

Frequently Asked Questions

What is the IUPAC name of 2-methylprop-2-enoate;tributylsilanylium?
The IUPAC name of 2-methylprop-2-enoate;tributylsilanylium (CID 159425085) is 2-methylprop-2-enoate;tributylsilanylium.
What is the SMILES notation for 2-methylprop-2-enoate;tributylsilanylium?
The canonical SMILES for 2-methylprop-2-enoate;tributylsilanylium is C=C(C)C(=O)[O-].CCCC[SiH2+](CCCC)CCCC.
What is the InChIKey of 2-methylprop-2-enoate;tributylsilanylium?
The InChIKey is WUKVMQSNYJWAMV-UHFFFAOYSA-M. The full InChI is InChI=1S/C12H29Si.C4H6O2/c1-4-7-10-13(11-8-5-2)12-9-6-3;1-3(2)4(5)6/h4-13H2,1-3H3;1H2,2H3,(H,5,6)/q+1;/p-1.
What are the key properties of 2-methylprop-2-enoate;tributylsilanylium?
2-methylprop-2-enoate;tributylsilanylium has a molecular weight of 286.53 g/mol, XLogP of 3.66, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylprop-2-enoate;tributylsilanylium is sourced from PubChem (CID 159425085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).