3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate

C16H32O4Si3 — CID 57240407

IUPAC3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate
SMILESC=C[Si](C)(C)O[Si](C)(CCCOC(=O)C=CC)O[Si](C)(C)C=C
InChIInChI=1S/C16H32O4Si3/c1-9-13-16(17)18-14-12-15-23(8,19-21(4,5)10-2)20-22(6,7)11-3/h9-11,13H,2-3,12,14-15H2,1,4-8H3
InChIKeyUCSJDGGECHMQAF-UHFFFAOYSA-N
MW372.69 g/mol
LogP4.46
Rot. Bonds11

About 3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate

3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate (PubChem CID 57240407) has the molecular formula C16H32O4Si3 and a molecular weight of 372.69 g/mol. Its IUPAC name is 3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate.

Molecular Properties

Compound Name3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate
PubChem CID57240407
Molecular FormulaC16H32O4Si3
Molecular Weight372.69 g/mol
Exact Mass372.16
IUPAC Name3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate
SMILESC=C[Si](C)(C)O[Si](C)(CCCOC(=O)C=CC)O[Si](C)(C)C=C
InChIInChI=1S/C16H32O4Si3/c1-9-13-16(17)18-14-12-15-23(8,19-21(4,5)10-2)20-22(6,7)11-3/h9-11,13H,2-3,12,14-15H2,1,4-8H3
InChIKeyUCSJDGGECHMQAF-UHFFFAOYSA-N
XLogP4.46
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.69
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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-[bis[[ethenyl(dimethyl)silyl]oxy]methylsilyl]propyl but-2-enoate
CID 123266848
3-(methoxy-methyl-propoxysilyl)propyl but-2-enoate
CID 141003620
3-[bis(3-but-2-enoyloxypropyl)-methoxysilyl]propyl but-2-enoate
CID 57318763
3-tri(propan-2-yl)silylpropyl but-2-enoate
CID 91430273
4-[fluoro(dimethyl)silyl]butyl but-2-enoate
CID 174106106
hydroxysilane;3-trimethoxysilylpropyl but-2-enoate
CID 174908985
3-[tris[tris(hydroxymethyl)silyloxy]silyl]propyl but-2-enoate
CID 91235537
3-[methyl(diphenyl)silyl]propyl but-2-enoate
CID 69118200
3-triacetyloxysilylpropyl but-2-enoate
CID 57008855
5-[chloro(dimethyl)silyl]pentyl but-2-enoate
CID 174106073
19-[bromo(dimethyl)silyl]nonadecyl but-2-enoate
CID 174106044
4-trifluorosilylbutyl but-2-enoate
CID 174106149

Frequently Asked Questions

What is the IUPAC name of 3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate?
The IUPAC name of 3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate (CID 57240407) is 3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate.
What is the SMILES notation for 3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate?
The canonical SMILES for 3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate is C=C[Si](C)(C)O[Si](C)(CCCOC(=O)C=CC)O[Si](C)(C)C=C.
What is the InChIKey of 3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate?
The InChIKey is UCSJDGGECHMQAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O4Si3/c1-9-13-16(17)18-14-12-15-23(8,19-21(4,5)10-2)20-22(6,7)11-3/h9-11,13H,2-3,12,14-15H2,1,4-8H3.
What are the key properties of 3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate?
3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate has a molecular weight of 372.69 g/mol, XLogP of 4.46, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[bis[[ethenyl(dimethyl)silyl]oxy]-methylsilyl]propyl but-2-enoate is sourced from PubChem (CID 57240407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).