3-[methyl(silyl)silyl]propyl prop-2-enoate

C7H16O2Si2 — CID 154347322

IUPAC3-[methyl(silyl)silyl]propyl prop-2-enoate
SMILESC=CC(=O)OCCC[SiH](C)[SiH3]
InChIInChI=1S/C7H16O2Si2/c1-3-7(8)9-5-4-6-11(2)10/h3,11H,1,4-6H2,2,10H3
InChIKeyWEVKEHXEJSEXFH-UHFFFAOYSA-N
MW188.37 g/mol
LogP-0.18
Rot. Bonds5

About 3-[methyl(silyl)silyl]propyl prop-2-enoate

3-[methyl(silyl)silyl]propyl prop-2-enoate (PubChem CID 154347322) has the molecular formula C7H16O2Si2 and a molecular weight of 188.37 g/mol. Its IUPAC name is 3-[methyl(silyl)silyl]propyl prop-2-enoate.

Molecular Properties

Compound Name3-[methyl(silyl)silyl]propyl prop-2-enoate
PubChem CID154347322
Molecular FormulaC7H16O2Si2
Molecular Weight188.37 g/mol
Exact Mass188.07
IUPAC Name3-[methyl(silyl)silyl]propyl prop-2-enoate
SMILESC=CC(=O)OCCC[SiH](C)[SiH3]
InChIInChI=1S/C7H16O2Si2/c1-3-7(8)9-5-4-6-11(2)10/h3,11H,1,4-6H2,2,10H3
InChIKeyWEVKEHXEJSEXFH-UHFFFAOYSA-N
XLogP-0.18
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.37
LogP ≤ 5-0.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

azane;3-prop-2-enoyloxypropyl prop-2-enoate
CID 162679005
8-prop-2-enoyloxyoctyl prop-2-enoate
CID 12934232
4-prop-2-enoyloxybutyl prop-2-enoate;6-prop-2-enoyloxyhexyl prop-2-enoate
CID 158256375
3-diethoxysilylpropyl prop-2-enoate
CID 123313393
14-fluorotetradecyl prop-2-enoate
CID 142675259
11-fluoroundecyl prop-2-enoate
CID 88673047
10-hydroxydecyl prop-2-enoate
CID 14715958
2-hydroxyethyl prop-2-enoate;3-hydroxypropyl prop-2-enoate
CID 87909374
12-hydroxydodecyl prop-2-enoate
CID 19859974
4-methoxybutyl prop-2-enoate
CID 22321356
11-hydroxyundecyl prop-2-enoate
CID 54223498
19-hydroxynonadecyl prop-2-enoate
CID 20625688

Frequently Asked Questions

What is the IUPAC name of 3-[methyl(silyl)silyl]propyl prop-2-enoate?
The IUPAC name of 3-[methyl(silyl)silyl]propyl prop-2-enoate (CID 154347322) is 3-[methyl(silyl)silyl]propyl prop-2-enoate.
What is the SMILES notation for 3-[methyl(silyl)silyl]propyl prop-2-enoate?
The canonical SMILES for 3-[methyl(silyl)silyl]propyl prop-2-enoate is C=CC(=O)OCCC[SiH](C)[SiH3].
What is the InChIKey of 3-[methyl(silyl)silyl]propyl prop-2-enoate?
The InChIKey is WEVKEHXEJSEXFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O2Si2/c1-3-7(8)9-5-4-6-11(2)10/h3,11H,1,4-6H2,2,10H3.
What are the key properties of 3-[methyl(silyl)silyl]propyl prop-2-enoate?
3-[methyl(silyl)silyl]propyl prop-2-enoate has a molecular weight of 188.37 g/mol, XLogP of -0.18, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methyl(silyl)silyl]propyl prop-2-enoate is sourced from PubChem (CID 154347322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).