but-2-enyl prop-2-enoate;ethene;trimethoxysilane

C12H24O5Si — CID 174451468

IUPACbut-2-enyl prop-2-enoate;ethene;trimethoxysilane
SMILESC=C.C=CC(=O)OCC=CC.CO[SiH](OC)OC
InChIInChI=1S/C7H10O2.C3H10O3Si.C2H4/c1-3-5-6-9-7(8)4-2;1-4-7(5-2)6-3;1-2/h3-5H,2,6H2,1H3;7H,1-3H3;1-2H2
InChIKeyUEOWLGFGNLNAAZ-UHFFFAOYSA-N
MW276.41 g/mol
LogP1.74
Rot. Bonds6

About but-2-enyl prop-2-enoate;ethene;trimethoxysilane

but-2-enyl prop-2-enoate;ethene;trimethoxysilane (PubChem CID 174451468) has the molecular formula C12H24O5Si and a molecular weight of 276.41 g/mol. Its IUPAC name is but-2-enyl prop-2-enoate;ethene;trimethoxysilane.

Molecular Properties

Compound Namebut-2-enyl prop-2-enoate;ethene;trimethoxysilane
PubChem CID174451468
Molecular FormulaC12H24O5Si
Molecular Weight276.41 g/mol
Exact Mass276.14
IUPAC Namebut-2-enyl prop-2-enoate;ethene;trimethoxysilane
SMILESC=C.C=CC(=O)OCC=CC.CO[SiH](OC)OC
InChIInChI=1S/C7H10O2.C3H10O3Si.C2H4/c1-3-5-6-9-7(8)4-2;1-4-7(5-2)6-3;1-2/h3-5H,2,6H2,1H3;7H,1-3H3;1-2H2
InChIKeyUEOWLGFGNLNAAZ-UHFFFAOYSA-N
XLogP1.74
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.41
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

but-2-enyl prop-2-enoate;ethene;prop-2-enoic acid
CID 174361149
buta-1,3-diene;but-2-enyl prop-2-enoate;prop-2-enoic acid
CID 175280821
but-2-enyl prop-2-enoate;but-2-ynoic acid
CID 175408783
4-O-[(E)-but-2-enyl] 1-O-methyl (Z)-but-2-enedioate
CID 102248901
[(Z)-3-chloroprop-2-enyl] prop-2-enoate
CID 5354525
[(2E)-penta-2,4-dienyl] prop-2-enoate
CID 88501874
3-hydroxyprop-2-enyl prop-2-enoate;methane
CID 173438743
but-2-enyl 3-methylbut-2-enoate
CID 57303003
methane;prop-2-enyl prop-2-enoate
CID 87568259
but-2-enyl prop-2-enoate;1-(oxiran-2-yl)ethyl prop-2-enoate;propa-1,2-diene
CID 174889097
but-2-en-1-ol;methyl prop-2-enoate
CID 174878800
buta-1,3-diene;prop-2-enyl prop-2-enoate
CID 87253709

Frequently Asked Questions

What is the IUPAC name of but-2-enyl prop-2-enoate;ethene;trimethoxysilane?
The IUPAC name of but-2-enyl prop-2-enoate;ethene;trimethoxysilane (CID 174451468) is but-2-enyl prop-2-enoate;ethene;trimethoxysilane.
What is the SMILES notation for but-2-enyl prop-2-enoate;ethene;trimethoxysilane?
The canonical SMILES for but-2-enyl prop-2-enoate;ethene;trimethoxysilane is C=C.C=CC(=O)OCC=CC.CO[SiH](OC)OC.
What is the InChIKey of but-2-enyl prop-2-enoate;ethene;trimethoxysilane?
The InChIKey is UEOWLGFGNLNAAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O2.C3H10O3Si.C2H4/c1-3-5-6-9-7(8)4-2;1-4-7(5-2)6-3;1-2/h3-5H,2,6H2,1H3;7H,1-3H3;1-2H2.
What are the key properties of but-2-enyl prop-2-enoate;ethene;trimethoxysilane?
but-2-enyl prop-2-enoate;ethene;trimethoxysilane has a molecular weight of 276.41 g/mol, XLogP of 1.74, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for but-2-enyl prop-2-enoate;ethene;trimethoxysilane is sourced from PubChem (CID 174451468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).