CID 153345261

C3H5ClISi — CID 153345261

IUPAC
SMILESCC=C[Si](Cl)I
InChIInChI=1S/C3H5ClISi/c1-2-3-6(4)5/h2-3H,1H3
InChIKeyLNXKMUPQLOASAK-UHFFFAOYSA-N
MW231.52 g/mol
LogP2.26
Rot. Bonds1

About CID 153345261

CID 153345261 (PubChem CID 153345261) has the molecular formula C3H5ClISi and a molecular weight of 231.52 g/mol.

Molecular Properties

Compound NameCID 153345261
PubChem CID153345261
Molecular FormulaC3H5ClISi
Molecular Weight231.52 g/mol
Exact Mass230.89
IUPAC Name
SMILESCC=C[Si](Cl)I
InChIInChI=1S/C3H5ClISi/c1-2-3-6(4)5/h2-3H,1H3
InChIKeyLNXKMUPQLOASAK-UHFFFAOYSA-N
XLogP2.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.52
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 153345261?
The IUPAC name of CID 153345261 (CID 153345261) is not available.
What is the SMILES notation for CID 153345261?
The canonical SMILES for CID 153345261 is CC=C[Si](Cl)I.
What is the InChIKey of CID 153345261?
The InChIKey is LNXKMUPQLOASAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5ClISi/c1-2-3-6(4)5/h2-3H,1H3.
What are the key properties of CID 153345261?
CID 153345261 has a molecular weight of 231.52 g/mol, XLogP of 2.26, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 153345261 is sourced from PubChem (CID 153345261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).