formic acid;indigane;zinc

CH5InO2Zn — CID 173358039

IUPACformic acid;indigane;zinc
SMILESO=CO.[InH3].[Zn]
InChIInChI=1S/CH2O2.In.Zn.3H/c2-1-3;;;;;/h1H,(H,2,3);;;;;
InChIKeyKKMKZSKGAJWUBK-UHFFFAOYSA-N
MW229.26 g/mol
LogP-1.49
Rot. Bonds

About formic acid;indigane;zinc

formic acid;indigane;zinc (PubChem CID 173358039) has the molecular formula CH5InO2Zn and a molecular weight of 229.26 g/mol. Its IUPAC name is formic acid;indigane;zinc.

Molecular Properties

Compound Nameformic acid;indigane;zinc
PubChem CID173358039
Molecular FormulaCH5InO2Zn
Molecular Weight229.26 g/mol
Exact Mass227.86
IUPAC Nameformic acid;indigane;zinc
SMILESO=CO.[InH3].[Zn]
InChIInChI=1S/CH2O2.In.Zn.3H/c2-1-3;;;;;/h1H,(H,2,3);;;;;
InChIKeyKKMKZSKGAJWUBK-UHFFFAOYSA-N
XLogP-1.49
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.26
LogP ≤ 5-1.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of formic acid;indigane;zinc?
The IUPAC name of formic acid;indigane;zinc (CID 173358039) is formic acid;indigane;zinc.
What is the SMILES notation for formic acid;indigane;zinc?
The canonical SMILES for formic acid;indigane;zinc is O=CO.[InH3].[Zn].
What is the InChIKey of formic acid;indigane;zinc?
The InChIKey is KKMKZSKGAJWUBK-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2O2.In.Zn.3H/c2-1-3;;;;;/h1H,(H,2,3);;;;;.
What are the key properties of formic acid;indigane;zinc?
formic acid;indigane;zinc has a molecular weight of 229.26 g/mol, XLogP of -1.49, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for formic acid;indigane;zinc is sourced from PubChem (CID 173358039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).