2,2-dichloropropane;zinc

C3H6Cl2Zn — CID 162195997

IUPAC2,2-dichloropropane;zinc
SMILESCC(C)(Cl)Cl.[Zn]
InChIInChI=1S/C3H6Cl2.Zn/c1-3(2,4)5;/h1-2H3;
InChIKeyZQYDKINJXKARMW-UHFFFAOYSA-N
MW178.38 g/mol
LogP2.20
Rot. Bonds

About 2,2-dichloropropane;zinc

2,2-dichloropropane;zinc (PubChem CID 162195997) has the molecular formula C3H6Cl2Zn and a molecular weight of 178.38 g/mol. Its IUPAC name is 2,2-dichloropropane;zinc.

Molecular Properties

Compound Name2,2-dichloropropane;zinc
PubChem CID162195997
Molecular FormulaC3H6Cl2Zn
Molecular Weight178.38 g/mol
Exact Mass175.91
IUPAC Name2,2-dichloropropane;zinc
SMILESCC(C)(Cl)Cl.[Zn]
InChIInChI=1S/C3H6Cl2.Zn/c1-3(2,4)5;/h1-2H3;
InChIKeyZQYDKINJXKARMW-UHFFFAOYSA-N
XLogP2.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.38
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 2,2-dichloropropane;zinc?
The IUPAC name of 2,2-dichloropropane;zinc (CID 162195997) is 2,2-dichloropropane;zinc.
What is the SMILES notation for 2,2-dichloropropane;zinc?
The canonical SMILES for 2,2-dichloropropane;zinc is CC(C)(Cl)Cl.[Zn].
What is the InChIKey of 2,2-dichloropropane;zinc?
The InChIKey is ZQYDKINJXKARMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6Cl2.Zn/c1-3(2,4)5;/h1-2H3;.
What are the key properties of 2,2-dichloropropane;zinc?
2,2-dichloropropane;zinc has a molecular weight of 178.38 g/mol, XLogP of 2.20, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dichloropropane;zinc is sourced from PubChem (CID 162195997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).