2-dimethylsilyloxybutyl 2-methylprop-2-enoate

C10H20O3Si — CID 123902003

IUPAC2-dimethylsilyloxybutyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC(CC)O[SiH](C)C
InChIInChI=1S/C10H20O3Si/c1-6-9(13-14(4)5)7-12-10(11)8(2)3/h9,14H,2,6-7H2,1,3-5H3
InChIKeyQQZBJYNIDLQPIE-UHFFFAOYSA-N
MW216.35 g/mol
LogP1.88
Rot. Bonds6

About 2-dimethylsilyloxybutyl 2-methylprop-2-enoate

2-dimethylsilyloxybutyl 2-methylprop-2-enoate (PubChem CID 123902003) has the molecular formula C10H20O3Si and a molecular weight of 216.35 g/mol. Its IUPAC name is 2-dimethylsilyloxybutyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name2-dimethylsilyloxybutyl 2-methylprop-2-enoate
PubChem CID123902003
Molecular FormulaC10H20O3Si
Molecular Weight216.35 g/mol
Exact Mass216.12
IUPAC Name2-dimethylsilyloxybutyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC(CC)O[SiH](C)C
InChIInChI=1S/C10H20O3Si/c1-6-9(13-14(4)5)7-12-10(11)8(2)3/h9,14H,2,6-7H2,1,3-5H3
InChIKeyQQZBJYNIDLQPIE-UHFFFAOYSA-N
XLogP1.88
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

butane-1,4-diol;2-(2-methylprop-2-enoyloxy)butyl 2-methylprop-2-enoate
CID 122641854
2-(2-methylprop-2-enoxy)butyl 2-methylprop-2-enoate
CID 153321870
2-ethenoxybutyl 2-methylprop-2-enoate
CID 87422864
1-(2-methylprop-2-enoyloxy)butan-2-yl 3-oxobutanoate
CID 23370738
triethyl(2-methylprop-2-enoyloxymethyl)phosphanium
CID 18683050
2,3-diacetyloxypropyl 2-methylprop-2-enoate
CID 18979747
2-dimethylsilyloxypentan-3-yl 2-methylprop-2-enoate
CID 173371342
ethane;2-methanidylpropyl 2-methylprop-2-enoate;tungsten(2+)
CID 20605307
ethane;(3-hydroxy-2-methylpropyl) 2-methylprop-2-enoate
CID 171797944
(2-ethyl-6-hydroxyhexyl) 2-methylprop-2-enoate
CID 87140924
2-[1,3-bis(2-methylprop-2-enoyloxy)propan-2-yloxycarbonyl]prop-2-enoic acid
CID 54328343
2-isocyanobutyl 2-methylprop-2-enoate
CID 141496484

Frequently Asked Questions

What is the IUPAC name of 2-dimethylsilyloxybutyl 2-methylprop-2-enoate?
The IUPAC name of 2-dimethylsilyloxybutyl 2-methylprop-2-enoate (CID 123902003) is 2-dimethylsilyloxybutyl 2-methylprop-2-enoate.
What is the SMILES notation for 2-dimethylsilyloxybutyl 2-methylprop-2-enoate?
The canonical SMILES for 2-dimethylsilyloxybutyl 2-methylprop-2-enoate is C=C(C)C(=O)OCC(CC)O[SiH](C)C.
What is the InChIKey of 2-dimethylsilyloxybutyl 2-methylprop-2-enoate?
The InChIKey is QQZBJYNIDLQPIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3Si/c1-6-9(13-14(4)5)7-12-10(11)8(2)3/h9,14H,2,6-7H2,1,3-5H3.
What are the key properties of 2-dimethylsilyloxybutyl 2-methylprop-2-enoate?
2-dimethylsilyloxybutyl 2-methylprop-2-enoate has a molecular weight of 216.35 g/mol, XLogP of 1.88, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dimethylsilyloxybutyl 2-methylprop-2-enoate is sourced from PubChem (CID 123902003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).