3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate

C15H30O5Si3 — CID 22325845

IUPAC3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate
SMILESC=C[Si](C)(C)O[Si](O)(CCCOC(=O)C(=C)C)O[Si](C)(C)C=C
InChIInChI=1S/C15H30O5Si3/c1-9-21(5,6)19-23(17,20-22(7,8)10-2)13-11-12-18-15(16)14(3)4/h9-10,17H,1-3,11-13H2,4-8H3
InChIKeyYHBXUCNHUKXBLZ-UHFFFAOYSA-N
MW374.66 g/mol
LogP3.32
Rot. Bonds11

About 3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate

3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate (PubChem CID 22325845) has the molecular formula C15H30O5Si3 and a molecular weight of 374.66 g/mol. Its IUPAC name is 3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate
PubChem CID22325845
Molecular FormulaC15H30O5Si3
Molecular Weight374.66 g/mol
Exact Mass374.14
IUPAC Name3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate
SMILESC=C[Si](C)(C)O[Si](O)(CCCOC(=O)C(=C)C)O[Si](C)(C)C=C
InChIInChI=1S/C15H30O5Si3/c1-9-21(5,6)19-23(17,20-22(7,8)10-2)13-11-12-18-15(16)14(3)4/h9-10,17H,1-3,11-13H2,4-8H3
InChIKeyYHBXUCNHUKXBLZ-UHFFFAOYSA-N
XLogP3.32
TPSA64.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.66
LogP ≤ 53.32
H-Bond Donors ≤ 51
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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Frequently Asked Questions

What is the IUPAC name of 3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate?
The IUPAC name of 3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate (CID 22325845) is 3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate.
What is the SMILES notation for 3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate?
The canonical SMILES for 3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate is C=C[Si](C)(C)O[Si](O)(CCCOC(=O)C(=C)C)O[Si](C)(C)C=C.
What is the InChIKey of 3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate?
The InChIKey is YHBXUCNHUKXBLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O5Si3/c1-9-21(5,6)19-23(17,20-22(7,8)10-2)13-11-12-18-15(16)14(3)4/h9-10,17H,1-3,11-13H2,4-8H3.
What are the key properties of 3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate?
3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate has a molecular weight of 374.66 g/mol, XLogP of 3.32, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[bis[[ethenyl(dimethyl)silyl]oxy]-hydroxysilyl]propyl 2-methylprop-2-enoate is sourced from PubChem (CID 22325845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).