ethyl dimethyl prop-2-enyl silicate

C7H16O4Si — CID 141231651

IUPACethyl dimethyl prop-2-enyl silicate
SMILESC=CCO[Si](OC)(OC)OCC
InChIInChI=1S/C7H16O4Si/c1-5-7-11-12(8-3,9-4)10-6-2/h5H,1,6-7H2,2-4H3
InChIKeyYFBCLQXDQGMDRQ-UHFFFAOYSA-N
MW192.29 g/mol
LogP0.95
Rot. Bonds7

About ethyl dimethyl prop-2-enyl silicate

ethyl dimethyl prop-2-enyl silicate (PubChem CID 141231651) has the molecular formula C7H16O4Si and a molecular weight of 192.29 g/mol. Its IUPAC name is ethyl dimethyl prop-2-enyl silicate.

Molecular Properties

Compound Nameethyl dimethyl prop-2-enyl silicate
PubChem CID141231651
Molecular FormulaC7H16O4Si
Molecular Weight192.29 g/mol
Exact Mass192.08
IUPAC Nameethyl dimethyl prop-2-enyl silicate
SMILESC=CCO[Si](OC)(OC)OCC
InChIInChI=1S/C7H16O4Si/c1-5-7-11-12(8-3,9-4)10-6-2/h5H,1,6-7H2,2-4H3
InChIKeyYFBCLQXDQGMDRQ-UHFFFAOYSA-N
XLogP0.95
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.29
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

diethyl bis(prop-2-enyl) silicate
CID 18764501
ethenyl-dimethoxy-methylsilane;tetraethyl silicate
CID 161359960
[diethoxy(hydroxy)silyl] diethyl methyl silicate
CID 101092888
ethyl dimethyl pentyl silicate
CID 88851017
chloro-dimethoxy-prop-2-enoxysilane
CID 151750059
bis(ethenyl)-diethoxysilane;bis(ethenyl)-dimethoxysilane
CID 88641201
ethanolate;silicon(4+);tetraethyl silicate
CID 157195326
but-1-ene;3-methoxyprop-1-ene
CID 157168477
trihydroxy(prop-2-enoxy)silane
CID 87688044
ethenyl diethoxy methyl silicate
CID 87232139
chloro-diethyl-prop-2-enoxysilane
CID 11975482
ethoxy-dimethyl-prop-2-enylsilane
CID 568563

Frequently Asked Questions

What is the IUPAC name of ethyl dimethyl prop-2-enyl silicate?
The IUPAC name of ethyl dimethyl prop-2-enyl silicate (CID 141231651) is ethyl dimethyl prop-2-enyl silicate.
What is the SMILES notation for ethyl dimethyl prop-2-enyl silicate?
The canonical SMILES for ethyl dimethyl prop-2-enyl silicate is C=CCO[Si](OC)(OC)OCC.
What is the InChIKey of ethyl dimethyl prop-2-enyl silicate?
The InChIKey is YFBCLQXDQGMDRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O4Si/c1-5-7-11-12(8-3,9-4)10-6-2/h5H,1,6-7H2,2-4H3.
What are the key properties of ethyl dimethyl prop-2-enyl silicate?
ethyl dimethyl prop-2-enyl silicate has a molecular weight of 192.29 g/mol, XLogP of 0.95, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl dimethyl prop-2-enyl silicate is sourced from PubChem (CID 141231651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).