CID 18991943

C6H11Cl2O2Si — CID 18991943

IUPAC—
SMILESC1CCC1.CC(=O)O[Si](Cl)Cl
InChIInChI=1S/C4H8.C2H3Cl2O2Si/c1-2-4-3-1;1-2(5)6-7(3)4/h1-4H2;1H3
InChIKeyQOUPIUJYMDKWCD-UHFFFAOYSA-N
MW214.14 g/mol
LogP2.57
Rot. Bonds1

About CID 18991943

CID 18991943 (PubChem CID 18991943) has the molecular formula C6H11Cl2O2Si and a molecular weight of 214.14 g/mol.

Molecular Properties

Compound NameCID 18991943
PubChem CID18991943
Molecular FormulaC6H11Cl2O2Si
Molecular Weight214.14 g/mol
Exact Mass212.99
IUPAC Name—
SMILESC1CCC1.CC(=O)O[Si](Cl)Cl
InChIInChI=1S/C4H8.C2H3Cl2O2Si/c1-2-4-3-1;1-2(5)6-7(3)4/h1-4H2;1H3
InChIKeyQOUPIUJYMDKWCD-UHFFFAOYSA-N
XLogP2.57
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.14
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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 CID 18991943?
The IUPAC name of CID 18991943 (CID 18991943) is not available.
What is the SMILES notation for CID 18991943?
The canonical SMILES for CID 18991943 is C1CCC1.CC(=O)O[Si](Cl)Cl.
What is the InChIKey of CID 18991943?
The InChIKey is QOUPIUJYMDKWCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8.C2H3Cl2O2Si/c1-2-4-3-1;1-2(5)6-7(3)4/h1-4H2;1H3.
What are the key properties of CID 18991943?
CID 18991943 has a molecular weight of 214.14 g/mol, XLogP of 2.57, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 18991943 is sourced from PubChem (CID 18991943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).