carbonic acid;chromium;iron

CH2CrFeO3 — CID 174788546

IUPACcarbonic acid;chromium;iron
SMILESO=C(O)O.[Cr].[Fe]
InChIInChI=1S/CH2O3.Cr.Fe/c2-1(3)4;;/h(H2,2,3,4);;
InChIKeyPMVIWBUSFIIPOB-UHFFFAOYSA-N
MW169.87 g/mol
LogP0.22
Rot. Bonds

About carbonic acid;chromium;iron

carbonic acid;chromium;iron (PubChem CID 174788546) has the molecular formula CH2CrFeO3 and a molecular weight of 169.87 g/mol. Its IUPAC name is carbonic acid;chromium;iron.

Molecular Properties

Compound Namecarbonic acid;chromium;iron
PubChem CID174788546
Molecular FormulaCH2CrFeO3
Molecular Weight169.87 g/mol
Exact Mass169.88
IUPAC Namecarbonic acid;chromium;iron
SMILESO=C(O)O.[Cr].[Fe]
InChIInChI=1S/CH2O3.Cr.Fe/c2-1(3)4;;/h(H2,2,3,4);;
InChIKeyPMVIWBUSFIIPOB-UHFFFAOYSA-N
XLogP0.22
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.87
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbonic acid;chromium;iron?
The IUPAC name of carbonic acid;chromium;iron (CID 174788546) is carbonic acid;chromium;iron.
What is the SMILES notation for carbonic acid;chromium;iron?
The canonical SMILES for carbonic acid;chromium;iron is O=C(O)O.[Cr].[Fe].
What is the InChIKey of carbonic acid;chromium;iron?
The InChIKey is PMVIWBUSFIIPOB-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2O3.Cr.Fe/c2-1(3)4;;/h(H2,2,3,4);;.
What are the key properties of carbonic acid;chromium;iron?
carbonic acid;chromium;iron has a molecular weight of 169.87 g/mol, XLogP of 0.22, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbonic acid;chromium;iron is sourced from PubChem (CID 174788546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).