chloro-dimethoxy-prop-2-enylsilane

C5H11ClO2Si — CID 22228829

IUPACchloro-dimethoxy-prop-2-enylsilane
SMILESC=CC[Si](Cl)(OC)OC
InChIInChI=1S/C5H11ClO2Si/c1-4-5-9(6,7-2)8-3/h4H,1,5H2,2-3H3
InChIKeyNCYRZXKPPTVWQC-UHFFFAOYSA-N
MW166.68 g/mol
LogP1.64
Rot. Bonds4

About chloro-dimethoxy-prop-2-enylsilane

chloro-dimethoxy-prop-2-enylsilane (PubChem CID 22228829) has the molecular formula C5H11ClO2Si and a molecular weight of 166.68 g/mol. Its IUPAC name is chloro-dimethoxy-prop-2-enylsilane.

Molecular Properties

Compound Namechloro-dimethoxy-prop-2-enylsilane
PubChem CID22228829
Molecular FormulaC5H11ClO2Si
Molecular Weight166.68 g/mol
Exact Mass166.02
IUPAC Namechloro-dimethoxy-prop-2-enylsilane
SMILESC=CC[Si](Cl)(OC)OC
InChIInChI=1S/C5H11ClO2Si/c1-4-5-9(6,7-2)8-3/h4H,1,5H2,2-3H3
InChIKeyNCYRZXKPPTVWQC-UHFFFAOYSA-N
XLogP1.64
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.68
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro-dimethoxy-prop-2-enylsilane?
The IUPAC name of chloro-dimethoxy-prop-2-enylsilane (CID 22228829) is chloro-dimethoxy-prop-2-enylsilane.
What is the SMILES notation for chloro-dimethoxy-prop-2-enylsilane?
The canonical SMILES for chloro-dimethoxy-prop-2-enylsilane is C=CC[Si](Cl)(OC)OC.
What is the InChIKey of chloro-dimethoxy-prop-2-enylsilane?
The InChIKey is NCYRZXKPPTVWQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11ClO2Si/c1-4-5-9(6,7-2)8-3/h4H,1,5H2,2-3H3.
What are the key properties of chloro-dimethoxy-prop-2-enylsilane?
chloro-dimethoxy-prop-2-enylsilane has a molecular weight of 166.68 g/mol, XLogP of 1.64, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-dimethoxy-prop-2-enylsilane is sourced from PubChem (CID 22228829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).