trichlorosilylmethyl 2-methylprop-2-enoate

C5H7Cl3O2Si — CID 22457275

IUPACtrichlorosilylmethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC[Si](Cl)(Cl)Cl
InChIInChI=1S/C5H7Cl3O2Si/c1-4(2)5(9)10-3-11(6,7)8/h1,3H2,2H3
InChIKeyXQKMFONTMNZENM-UHFFFAOYSA-N
MW233.55 g/mol
LogP2.30
Rot. Bonds3

About trichlorosilylmethyl 2-methylprop-2-enoate

trichlorosilylmethyl 2-methylprop-2-enoate (PubChem CID 22457275) has the molecular formula C5H7Cl3O2Si and a molecular weight of 233.55 g/mol. Its IUPAC name is trichlorosilylmethyl 2-methylprop-2-enoate.

Molecular Properties

Compound Nametrichlorosilylmethyl 2-methylprop-2-enoate
PubChem CID22457275
Molecular FormulaC5H7Cl3O2Si
Molecular Weight233.55 g/mol
Exact Mass231.93
IUPAC Nametrichlorosilylmethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC[Si](Cl)(Cl)Cl
InChIInChI=1S/C5H7Cl3O2Si/c1-4(2)5(9)10-3-11(6,7)8/h1,3H2,2H3
InChIKeyXQKMFONTMNZENM-UHFFFAOYSA-N
XLogP2.30
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.55
LogP ≤ 52.30
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

[chloro(diethyl)silyl]methyl 2-methylprop-2-enoate
CID 156690529
[dicarboxy(2-methylprop-2-enoyloxymethyl)silyl]formic acid
CID 163406071
4-[dichloro-[4-(2-methylprop-2-enoyloxy)butyl]silyl]butyl 2-methylprop-2-enoate
CID 139796033
14-trichlorosilyltetradecyl 2-methylprop-2-enoate
CID 156681386
17-trichlorosilylheptadecyl 2-methylprop-2-enoate
CID 156681417
ethyl 2-methylprop-2-enoate
CID 130475774
ethene;2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate
CID 173009937
hydroxymethyl 2-methylprop-2-enoate
CID 159274421
tripropoxysilylmethyl 2-methylprop-2-enoate
CID 22266632
2-[chloro(diethyl)silyl]ethyl 2-methylprop-2-enoate
CID 156690552
tris(tripropylsilyloxy)silylmethyl 2-methylprop-2-enoate
CID 171058420
[dimethyl(prop-2-enoyloxymethyl)silyl]methyl 2-methylprop-2-enoate
CID 150664135

Frequently Asked Questions

What is the IUPAC name of trichlorosilylmethyl 2-methylprop-2-enoate?
The IUPAC name of trichlorosilylmethyl 2-methylprop-2-enoate (CID 22457275) is trichlorosilylmethyl 2-methylprop-2-enoate.
What is the SMILES notation for trichlorosilylmethyl 2-methylprop-2-enoate?
The canonical SMILES for trichlorosilylmethyl 2-methylprop-2-enoate is C=C(C)C(=O)OC[Si](Cl)(Cl)Cl.
What is the InChIKey of trichlorosilylmethyl 2-methylprop-2-enoate?
The InChIKey is XQKMFONTMNZENM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7Cl3O2Si/c1-4(2)5(9)10-3-11(6,7)8/h1,3H2,2H3.
What are the key properties of trichlorosilylmethyl 2-methylprop-2-enoate?
trichlorosilylmethyl 2-methylprop-2-enoate has a molecular weight of 233.55 g/mol, XLogP of 2.30, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trichlorosilylmethyl 2-methylprop-2-enoate is sourced from PubChem (CID 22457275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).