CID 57254568

C3H6ClOSi — CID 57254568

IUPAC—
SMILESCCC(Cl)O[Si]
InChIInChI=1S/C3H6ClOSi/c1-2-3(4)5-6/h3H,2H2,1H3
InChIKeyKVWSNTVOGOQBPK-UHFFFAOYSA-N
MW121.62 g/mol
LogP1.06
Rot. Bonds2

About CID 57254568

CID 57254568 (PubChem CID 57254568) has the molecular formula C3H6ClOSi and a molecular weight of 121.62 g/mol.

Molecular Properties

Compound NameCID 57254568
PubChem CID57254568
Molecular FormulaC3H6ClOSi
Molecular Weight121.62 g/mol
Exact Mass120.99
IUPAC Name—
SMILESCCC(Cl)O[Si]
InChIInChI=1S/C3H6ClOSi/c1-2-3(4)5-6/h3H,2H2,1H3
InChIKeyKVWSNTVOGOQBPK-UHFFFAOYSA-N
XLogP1.06
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.62
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 57254568?
The IUPAC name of CID 57254568 (CID 57254568) is not available.
What is the SMILES notation for CID 57254568?
The canonical SMILES for CID 57254568 is CCC(Cl)O[Si].
What is the InChIKey of CID 57254568?
The InChIKey is KVWSNTVOGOQBPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6ClOSi/c1-2-3(4)5-6/h3H,2H2,1H3.
What are the key properties of CID 57254568?
CID 57254568 has a molecular weight of 121.62 g/mol, XLogP of 1.06, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 57254568 is sourced from PubChem (CID 57254568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).