iodozinc(1+);trifluoromethylbenzene

C7H4F3IZn — CID 14980131

IUPACiodozinc(1+);trifluoromethylbenzene
SMILESFC(F)(F)c1[c-]cccc1.[Zn+]I
InChIInChI=1S/C7H4F3.HI.Zn/c8-7(9,10)6-4-2-1-3-5-6;;/h1-4H;1H;/q-1;;+2/p-1
InChIKeyVWZBBBCFZIMSHO-UHFFFAOYSA-M
MW337.40 g/mol
LogP3.39
Rot. Bonds

About iodozinc(1+);trifluoromethylbenzene

iodozinc(1+);trifluoromethylbenzene (PubChem CID 14980131) has the molecular formula C7H4F3IZn and a molecular weight of 337.40 g/mol. Its IUPAC name is iodozinc(1+);trifluoromethylbenzene.

Molecular Properties

Compound Nameiodozinc(1+);trifluoromethylbenzene
PubChem CID14980131
Molecular FormulaC7H4F3IZn
Molecular Weight337.40 g/mol
Exact Mass335.86
IUPAC Nameiodozinc(1+);trifluoromethylbenzene
SMILESFC(F)(F)c1[c-]cccc1.[Zn+]I
InChIInChI=1S/C7H4F3.HI.Zn/c8-7(9,10)6-4-2-1-3-5-6;;/h1-4H;1H;/q-1;;+2/p-1
InChIKeyVWZBBBCFZIMSHO-UHFFFAOYSA-M
XLogP3.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.40
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze iodozinc(1+);trifluoromethylbenzene with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of iodozinc(1+);trifluoromethylbenzene?
The IUPAC name of iodozinc(1+);trifluoromethylbenzene (CID 14980131) is iodozinc(1+);trifluoromethylbenzene.
What is the SMILES notation for iodozinc(1+);trifluoromethylbenzene?
The canonical SMILES for iodozinc(1+);trifluoromethylbenzene is FC(F)(F)c1[c-]cccc1.[Zn+]I.
What is the InChIKey of iodozinc(1+);trifluoromethylbenzene?
The InChIKey is VWZBBBCFZIMSHO-UHFFFAOYSA-M. The full InChI is InChI=1S/C7H4F3.HI.Zn/c8-7(9,10)6-4-2-1-3-5-6;;/h1-4H;1H;/q-1;;+2/p-1.
What are the key properties of iodozinc(1+);trifluoromethylbenzene?
iodozinc(1+);trifluoromethylbenzene has a molecular weight of 337.40 g/mol, XLogP of 3.39, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for iodozinc(1+);trifluoromethylbenzene is sourced from PubChem (CID 14980131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).