[dichloro(ethyl)silyl]methyl prop-2-enoate

C6H10Cl2O2Si — CID 140514635

IUPAC[dichloro(ethyl)silyl]methyl prop-2-enoate
SMILESC=CC(=O)OC[Si](Cl)(Cl)CC
InChIInChI=1S/C6H10Cl2O2Si/c1-3-6(9)10-5-11(7,8)4-2/h3H,1,4-5H2,2H3
InChIKeySSMBFLWUXNQJCZ-UHFFFAOYSA-N
MW213.14 g/mol
LogP2.19
Rot. Bonds4

About [dichloro(ethyl)silyl]methyl prop-2-enoate

[dichloro(ethyl)silyl]methyl prop-2-enoate (PubChem CID 140514635) has the molecular formula C6H10Cl2O2Si and a molecular weight of 213.14 g/mol. Its IUPAC name is [dichloro(ethyl)silyl]methyl prop-2-enoate.

Molecular Properties

Compound Name[dichloro(ethyl)silyl]methyl prop-2-enoate
PubChem CID140514635
Molecular FormulaC6H10Cl2O2Si
Molecular Weight213.14 g/mol
Exact Mass211.98
IUPAC Name[dichloro(ethyl)silyl]methyl prop-2-enoate
SMILESC=CC(=O)OC[Si](Cl)(Cl)CC
InChIInChI=1S/C6H10Cl2O2Si/c1-3-6(9)10-5-11(7,8)4-2/h3H,1,4-5H2,2H3
InChIKeySSMBFLWUXNQJCZ-UHFFFAOYSA-N
XLogP2.19
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.14
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

[diethylamino(dimethyl)silyl]methyl prop-2-enoate
CID 18954911
tri(butan-2-yl)silylmethyl prop-2-enoate
CID 141363387
ethenamine;ethyl prop-2-enoate
CID 22022699
ethyl prop-2-enoate;sulfane
CID 157093783
ethyl prop-2-enoate;hydrochloride
CID 87359594
ethyl prop-2-enoate;hydroiodide
CID 159738872
(ethoxy-ethyl-propylsilyl)methyl prop-2-enoate
CID 141190333
chloroethene;ethene;ethyl prop-2-enoate
CID 86733401
CID 166519746
CID 166519746
2-triethylsilyloxyethyl prop-2-enoate
CID 54487061
tris(2-methylprop-2-enyl)silylmethyl prop-2-enoate
CID 167321925
(ethyl-methyl-phenylsilyl)methyl prop-2-enoate
CID 141219391

Frequently Asked Questions

What is the IUPAC name of [dichloro(ethyl)silyl]methyl prop-2-enoate?
The IUPAC name of [dichloro(ethyl)silyl]methyl prop-2-enoate (CID 140514635) is [dichloro(ethyl)silyl]methyl prop-2-enoate.
What is the SMILES notation for [dichloro(ethyl)silyl]methyl prop-2-enoate?
The canonical SMILES for [dichloro(ethyl)silyl]methyl prop-2-enoate is C=CC(=O)OC[Si](Cl)(Cl)CC.
What is the InChIKey of [dichloro(ethyl)silyl]methyl prop-2-enoate?
The InChIKey is SSMBFLWUXNQJCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10Cl2O2Si/c1-3-6(9)10-5-11(7,8)4-2/h3H,1,4-5H2,2H3.
What are the key properties of [dichloro(ethyl)silyl]methyl prop-2-enoate?
[dichloro(ethyl)silyl]methyl prop-2-enoate has a molecular weight of 213.14 g/mol, XLogP of 2.19, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [dichloro(ethyl)silyl]methyl prop-2-enoate is sourced from PubChem (CID 140514635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).