CID 173437916

CH2AsO2Zr — CID 173437916

IUPAC—
SMILESO=C(O)[AsH].[Zr]
InChIInChI=1S/CH2AsO2.Zr/c2-1(3)4;/h2H,(H,3,4);
InChIKeyOWBWHVLYQASEBI-UHFFFAOYSA-N
MW212.17 g/mol
LogP-0.44
Rot. Bonds

About CID 173437916

CID 173437916 (PubChem CID 173437916) has the molecular formula CH2AsO2Zr and a molecular weight of 212.17 g/mol.

Molecular Properties

Compound NameCID 173437916
PubChem CID173437916
Molecular FormulaCH2AsO2Zr
Molecular Weight212.17 g/mol
Exact Mass210.83
IUPAC Name—
SMILESO=C(O)[AsH].[Zr]
InChIInChI=1S/CH2AsO2.Zr/c2-1(3)4;/h2H,(H,3,4);
InChIKeyOWBWHVLYQASEBI-UHFFFAOYSA-N
XLogP-0.44
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.17
LogP ≤ 5-0.44
H-Bond Donors ≤ 51
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 CID 173437916?
The IUPAC name of CID 173437916 (CID 173437916) is not available.
What is the SMILES notation for CID 173437916?
The canonical SMILES for CID 173437916 is O=C(O)[AsH].[Zr].
What is the InChIKey of CID 173437916?
The InChIKey is OWBWHVLYQASEBI-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2AsO2.Zr/c2-1(3)4;/h2H,(H,3,4);.
What are the key properties of CID 173437916?
CID 173437916 has a molecular weight of 212.17 g/mol, XLogP of -0.44, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173437916 is sourced from PubChem (CID 173437916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).