chlorosilane;furan-2,5-dione

C4H5ClO3Si — CID 160689927

IUPACchlorosilane;furan-2,5-dione
SMILESO=C1C=CC(=O)O1.[SiH3]Cl
InChIInChI=1S/C4H2O3.ClH3Si/c5-3-1-2-4(6)7-3;1-2/h1-2H;2H3
InChIKeyRPGRSIPDSWWXED-UHFFFAOYSA-N
MW164.62 g/mol
LogP-0.87
Rot. Bonds

About chlorosilane;furan-2,5-dione

chlorosilane;furan-2,5-dione (PubChem CID 160689927) has the molecular formula C4H5ClO3Si and a molecular weight of 164.62 g/mol. Its IUPAC name is chlorosilane;furan-2,5-dione.

Molecular Properties

Compound Namechlorosilane;furan-2,5-dione
PubChem CID160689927
Molecular FormulaC4H5ClO3Si
Molecular Weight164.62 g/mol
Exact Mass163.97
IUPAC Namechlorosilane;furan-2,5-dione
SMILESO=C1C=CC(=O)O1.[SiH3]Cl
InChIInChI=1S/C4H2O3.ClH3Si/c5-3-1-2-4(6)7-3;1-2/h1-2H;2H3
InChIKeyRPGRSIPDSWWXED-UHFFFAOYSA-N
XLogP-0.87
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.62
LogP ≤ 5-0.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of chlorosilane;furan-2,5-dione?
The IUPAC name of chlorosilane;furan-2,5-dione (CID 160689927) is chlorosilane;furan-2,5-dione.
What is the SMILES notation for chlorosilane;furan-2,5-dione?
The canonical SMILES for chlorosilane;furan-2,5-dione is O=C1C=CC(=O)O1.[SiH3]Cl.
What is the InChIKey of chlorosilane;furan-2,5-dione?
The InChIKey is RPGRSIPDSWWXED-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H2O3.ClH3Si/c5-3-1-2-4(6)7-3;1-2/h1-2H;2H3.
What are the key properties of chlorosilane;furan-2,5-dione?
chlorosilane;furan-2,5-dione has a molecular weight of 164.62 g/mol, XLogP of -0.87, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for chlorosilane;furan-2,5-dione is sourced from PubChem (CID 160689927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).