CID 87223415

CH2AsO — CID 87223415

IUPAC—
SMILESC=O.[As]
InChIInChI=1S/CH2O.As/c1-2;/h1H2;
InChIKeyOVUZGTQLMBRNCE-UHFFFAOYSA-N
MW104.95 g/mol
LogP-0.57
Rot. Bonds

About CID 87223415

CID 87223415 (PubChem CID 87223415) has the molecular formula CH2AsO and a molecular weight of 104.95 g/mol.

Molecular Properties

Compound NameCID 87223415
PubChem CID87223415
Molecular FormulaCH2AsO
Molecular Weight104.95 g/mol
Exact Mass104.93
IUPAC Name—
SMILESC=O.[As]
InChIInChI=1S/CH2O.As/c1-2;/h1H2;
InChIKeyOVUZGTQLMBRNCE-UHFFFAOYSA-N
XLogP-0.57
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.95
LogP ≤ 5-0.57
H-Bond Donors ≤ 50
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 87223415?
The IUPAC name of CID 87223415 (CID 87223415) is not available.
What is the SMILES notation for CID 87223415?
The canonical SMILES for CID 87223415 is C=O.[As].
What is the InChIKey of CID 87223415?
The InChIKey is OVUZGTQLMBRNCE-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2O.As/c1-2;/h1H2;.
What are the key properties of CID 87223415?
CID 87223415 has a molecular weight of 104.95 g/mol, XLogP of -0.57, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87223415 is sourced from PubChem (CID 87223415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).