dichlorosilylmethyl 2-methylprop-2-enoate

C5H8Cl2O2Si — CID 123971676

IUPACdichlorosilylmethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC[SiH](Cl)Cl
InChIInChI=1S/C5H8Cl2O2Si/c1-4(2)5(8)9-3-10(6)7/h10H,1,3H2,2H3
InChIKeyPMNKOVMEZWWRAS-UHFFFAOYSA-N
MW199.11 g/mol
LogP1.34
Rot. Bonds3

About dichlorosilylmethyl 2-methylprop-2-enoate

dichlorosilylmethyl 2-methylprop-2-enoate (PubChem CID 123971676) has the molecular formula C5H8Cl2O2Si and a molecular weight of 199.11 g/mol. Its IUPAC name is dichlorosilylmethyl 2-methylprop-2-enoate.

Molecular Properties

Compound Namedichlorosilylmethyl 2-methylprop-2-enoate
PubChem CID123971676
Molecular FormulaC5H8Cl2O2Si
Molecular Weight199.11 g/mol
Exact Mass197.97
IUPAC Namedichlorosilylmethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC[SiH](Cl)Cl
InChIInChI=1S/C5H8Cl2O2Si/c1-4(2)5(8)9-3-10(6)7/h10H,1,3H2,2H3
InChIKeyPMNKOVMEZWWRAS-UHFFFAOYSA-N
XLogP1.34
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.11
LogP ≤ 51.34
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

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
[amino(chloro)silyl] 2-methylprop-2-enoate
CID 154510963
azane;hydroxymethyl 2-methylprop-2-enoate
CID 172791973
sodium ethyl 2-methylprop-2-enoate
CID 23346885
ethyl 2-methylprop-2-enoate;phosphane
CID 159151613
ethane;bis(ethyl 2-methylprop-2-enoate)
CID 146295289
ethyl 2-methylprop-2-enoate;methane
CID 159235789
trichlorosilylmethyl 2-methylprop-2-enoate
CID 22457275
magnesium bis(ethyl 2-methylprop-2-enoate)
CID 174920026
tris(hydroxymethyl 2-methylprop-2-enoate);propane
CID 157070076

Frequently Asked Questions

What is the IUPAC name of dichlorosilylmethyl 2-methylprop-2-enoate?
The IUPAC name of dichlorosilylmethyl 2-methylprop-2-enoate (CID 123971676) is dichlorosilylmethyl 2-methylprop-2-enoate.
What is the SMILES notation for dichlorosilylmethyl 2-methylprop-2-enoate?
The canonical SMILES for dichlorosilylmethyl 2-methylprop-2-enoate is C=C(C)C(=O)OC[SiH](Cl)Cl.
What is the InChIKey of dichlorosilylmethyl 2-methylprop-2-enoate?
The InChIKey is PMNKOVMEZWWRAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8Cl2O2Si/c1-4(2)5(8)9-3-10(6)7/h10H,1,3H2,2H3.
What are the key properties of dichlorosilylmethyl 2-methylprop-2-enoate?
dichlorosilylmethyl 2-methylprop-2-enoate has a molecular weight of 199.11 g/mol, XLogP of 1.34, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dichlorosilylmethyl 2-methylprop-2-enoate is sourced from PubChem (CID 123971676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).