chloroethane;zinc

C2H4ClZn- — CID 78062530

IUPACchloroethane;zinc
SMILES[CH2-]CCl.[Zn]
InChIInChI=1S/C2H4Cl.Zn/c1-2-3;/h1-2H2;/q-1;
InChIKeyRLDRCWIADHGOCS-UHFFFAOYSA-N
MW128.90 g/mol
LogP1.06
Rot. Bonds

About chloroethane;zinc

chloroethane;zinc (PubChem CID 78062530) has the molecular formula C2H4ClZn- and a molecular weight of 128.90 g/mol. Its IUPAC name is chloroethane;zinc.

Molecular Properties

Compound Namechloroethane;zinc
PubChem CID78062530
Molecular FormulaC2H4ClZn-
Molecular Weight128.90 g/mol
Exact Mass126.93
IUPAC Namechloroethane;zinc
SMILES[CH2-]CCl.[Zn]
InChIInChI=1S/C2H4Cl.Zn/c1-2-3;/h1-2H2;/q-1;
InChIKeyRLDRCWIADHGOCS-UHFFFAOYSA-N
XLogP1.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.90
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze chloroethane;zinc with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-chloropropane;titanium
CID 174572587
dichloromethane;zinc;hydrochloride
CID 174925220
bromo(chloro)methane;hydrobromide
CID 174642403
bromozinc(1+);1-chloropropane
CID 171688021
beryllium;sodium;propane
CID 134905882
magnesium;1-chlorobutane;bromide
CID 11063336
(dichloromethane);pentacontahydrate
CID 173399237
dichloromethane;proton
CID 174889445
CID 87274674
CID 87274674
dichloromethane;germane
CID 174557663
azanide;dichlororuthenium;propane
CID 156682028
2-chloroacetonitrile
CID 11297929

Frequently Asked Questions

What is the IUPAC name of chloroethane;zinc?
The IUPAC name of chloroethane;zinc (CID 78062530) is chloroethane;zinc.
What is the SMILES notation for chloroethane;zinc?
The canonical SMILES for chloroethane;zinc is [CH2-]CCl.[Zn].
What is the InChIKey of chloroethane;zinc?
The InChIKey is RLDRCWIADHGOCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4Cl.Zn/c1-2-3;/h1-2H2;/q-1;.
What are the key properties of chloroethane;zinc?
chloroethane;zinc has a molecular weight of 128.90 g/mol, XLogP of 1.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloroethane;zinc is sourced from PubChem (CID 78062530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).