CID 19837826

C12H10AsO2 — CID 19837826

IUPAC—
SMILESO[As]Oc1ccccc1-c1ccccc1
InChIInChI=1S/C12H10AsO2/c14-13-15-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,14H
InChIKeyBHJMXARWDWUQJB-UHFFFAOYSA-N
MW261.13 g/mol
LogP2.26
Rot. Bonds3

About CID 19837826

CID 19837826 (PubChem CID 19837826) has the molecular formula C12H10AsO2 and a molecular weight of 261.13 g/mol.

Molecular Properties

Compound NameCID 19837826
PubChem CID19837826
Molecular FormulaC12H10AsO2
Molecular Weight261.13 g/mol
Exact Mass260.99
IUPAC Name—
SMILESO[As]Oc1ccccc1-c1ccccc1
InChIInChI=1S/C12H10AsO2/c14-13-15-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,14H
InChIKeyBHJMXARWDWUQJB-UHFFFAOYSA-N
XLogP2.26
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.13
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 19837826?
The IUPAC name of CID 19837826 (CID 19837826) is not available.
What is the SMILES notation for CID 19837826?
The canonical SMILES for CID 19837826 is O[As]Oc1ccccc1-c1ccccc1.
What is the InChIKey of CID 19837826?
The InChIKey is BHJMXARWDWUQJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10AsO2/c14-13-15-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9,14H.
What are the key properties of CID 19837826?
CID 19837826 has a molecular weight of 261.13 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 19837826 is sourced from PubChem (CID 19837826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).