[5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate

C13H30O5Si3 — CID 173182258

IUPAC[5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCCCC(O[SiH3])(O[SiH](C)C)O[SiH](C)C
InChIInChI=1S/C13H30O5Si3/c1-11(2)12(14)15-10-8-7-9-13(16-19,17-20(3)4)18-21(5)6/h20-21H,1,7-10H2,2-6,19H3
InChIKeyQAIKRRQIEVEUKG-UHFFFAOYSA-N
MW350.64 g/mol
LogP1.23
Rot. Bonds11

About [5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate

[5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate (PubChem CID 173182258) has the molecular formula C13H30O5Si3 and a molecular weight of 350.64 g/mol. Its IUPAC name is [5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate.

Molecular Properties

Compound Name[5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate
PubChem CID173182258
Molecular FormulaC13H30O5Si3
Molecular Weight350.64 g/mol
Exact Mass350.14
IUPAC Name[5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCCCCC(O[SiH3])(O[SiH](C)C)O[SiH](C)C
InChIInChI=1S/C13H30O5Si3/c1-11(2)12(14)15-10-8-7-9-13(16-19,17-20(3)4)18-21(5)6/h20-21H,1,7-10H2,2-6,19H3
InChIKeyQAIKRRQIEVEUKG-UHFFFAOYSA-N
XLogP1.23
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.64
LogP ≤ 51.23
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': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze [5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate with MolForge

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Related Compounds

hexane-1,6-diol;9-(2-methylprop-2-enoyloxy)nonyl 2-methylprop-2-enoate
CID 90169594
bis[4-(2-methylprop-2-enoyloxy)butyl] oxalate
CID 118147382
23,23-dimethyltetracosyl 2-methylprop-2-enoate
CID 178182049
4-hydroxybutyl 2-methylprop-2-enoate;2-hydroxyethyl 2-methylprop-2-enoate
CID 87803089
8,8-dimethyldecyl 2-methylprop-2-enoate
CID 58241592
ethene;4-(2-methylprop-2-enoyloxy)butyl 2-methylprop-2-enoate;6-(2-methylprop-2-enoyloxy)hexyl 2-methylprop-2-enoate
CID 88685309
4-[4-[4-(2-methylprop-2-enoyloxy)butoxy]butoxy]butyl 2-methylprop-2-enoate
CID 101360150
bis(ethane-1,2-diol);4-(2-methylprop-2-enoyloxy)butyl 2-methylprop-2-enoate
CID 88656789
4-acetyloxybutyl 2-methylprop-2-enoate
CID 21403527
4-(2-silyloxypropan-2-yl)octyl 2-methylprop-2-enoate
CID 173068945
3,3-dimethylpentyl 2-methylprop-2-enoate
CID 20670454
(4-methyl-4-silyloxysilylpentyl) 2-methylprop-2-enoate
CID 173295431

Frequently Asked Questions

What is the IUPAC name of [5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate?
The IUPAC name of [5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate (CID 173182258) is [5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate.
What is the SMILES notation for [5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate?
The canonical SMILES for [5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate is C=C(C)C(=O)OCCCCC(O[SiH3])(O[SiH](C)C)O[SiH](C)C.
What is the InChIKey of [5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate?
The InChIKey is QAIKRRQIEVEUKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30O5Si3/c1-11(2)12(14)15-10-8-7-9-13(16-19,17-20(3)4)18-21(5)6/h20-21H,1,7-10H2,2-6,19H3.
What are the key properties of [5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate?
[5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate has a molecular weight of 350.64 g/mol, XLogP of 1.23, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5,5-bis(dimethylsilyloxy)-5-silyloxypentyl] 2-methylprop-2-enoate is sourced from PubChem (CID 173182258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).