benzene;chromium;chromium(3+)

C18H15Cr2 — CID 175769091

IUPACbenzene;chromium;chromium(3+)
SMILES[Cr+3].[Cr].[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1
InChIInChI=1S/3C6H5.2Cr/c3*1-2-4-6-5-3-1;;/h3*1-5H;;/q3*-1;;+3
InChIKeyIXNLDWKQKHZWGG-UHFFFAOYSA-N
MW335.31 g/mol
LogP4.46
Rot. Bonds

About benzene;chromium;chromium(3+)

benzene;chromium;chromium(3+) (PubChem CID 175769091) has the molecular formula C18H15Cr2 and a molecular weight of 335.31 g/mol. Its IUPAC name is benzene;chromium;chromium(3+).

Molecular Properties

Compound Namebenzene;chromium;chromium(3+)
PubChem CID175769091
Molecular FormulaC18H15Cr2
Molecular Weight335.31 g/mol
Exact Mass335.00
IUPAC Namebenzene;chromium;chromium(3+)
SMILES[Cr+3].[Cr].[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1
InChIInChI=1S/3C6H5.2Cr/c3*1-2-4-6-5-3-1;;/h3*1-5H;;/q3*-1;;+3
InChIKeyIXNLDWKQKHZWGG-UHFFFAOYSA-N
XLogP4.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.31
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze benzene;chromium;chromium(3+) 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 benzene;chromium;chromium(3+)?
The IUPAC name of benzene;chromium;chromium(3+) (CID 175769091) is benzene;chromium;chromium(3+).
What is the SMILES notation for benzene;chromium;chromium(3+)?
The canonical SMILES for benzene;chromium;chromium(3+) is [Cr+3].[Cr].[c-]1ccccc1.[c-]1ccccc1.[c-]1ccccc1.
What is the InChIKey of benzene;chromium;chromium(3+)?
The InChIKey is IXNLDWKQKHZWGG-UHFFFAOYSA-N. The full InChI is InChI=1S/3C6H5.2Cr/c3*1-2-4-6-5-3-1;;/h3*1-5H;;/q3*-1;;+3.
What are the key properties of benzene;chromium;chromium(3+)?
benzene;chromium;chromium(3+) has a molecular weight of 335.31 g/mol, XLogP of 4.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;chromium;chromium(3+) is sourced from PubChem (CID 175769091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).