carbon monoxide;chromium;toluene

C10H8CrO3 — CID 11172208

IUPACcarbon monoxide;chromium;toluene
SMILESCc1ccccc1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]
InChIInChI=1S/C7H8.3CO.Cr/c1-7-5-3-2-4-6-7;3*1-2;/h2-6H,1H3;;;;
InChIKeyKEXFCQUTYPQKCG-UHFFFAOYSA-N
MW228.17 g/mol
LogP1.88
Rot. Bonds

About carbon monoxide;chromium;toluene

carbon monoxide;chromium;toluene (PubChem CID 11172208) has the molecular formula C10H8CrO3 and a molecular weight of 228.17 g/mol. Its IUPAC name is carbon monoxide;chromium;toluene.

Molecular Properties

Compound Namecarbon monoxide;chromium;toluene
PubChem CID11172208
Molecular FormulaC10H8CrO3
Molecular Weight228.17 g/mol
Exact Mass227.99
IUPAC Namecarbon monoxide;chromium;toluene
SMILESCc1ccccc1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]
InChIInChI=1S/C7H8.3CO.Cr/c1-7-5-3-2-4-6-7;3*1-2;/h2-6H,1H3;;;;
InChIKeyKEXFCQUTYPQKCG-UHFFFAOYSA-N
XLogP1.88
TPSA59.70 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.17
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbon monoxide;chromium;toluene?
The IUPAC name of carbon monoxide;chromium;toluene (CID 11172208) is carbon monoxide;chromium;toluene.
What is the SMILES notation for carbon monoxide;chromium;toluene?
The canonical SMILES for carbon monoxide;chromium;toluene is Cc1ccccc1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr].
What is the InChIKey of carbon monoxide;chromium;toluene?
The InChIKey is KEXFCQUTYPQKCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8.3CO.Cr/c1-7-5-3-2-4-6-7;3*1-2;/h2-6H,1H3;;;;.
What are the key properties of carbon monoxide;chromium;toluene?
carbon monoxide;chromium;toluene has a molecular weight of 228.17 g/mol, XLogP of 1.88, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbon monoxide;chromium;toluene is sourced from PubChem (CID 11172208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).