CID 172741873
H7AsBiOPSSb — CID 172741873
Data last refreshed: (MolForge compound catalog, from PubChem)
IUPAC—
SMILESO.P.S.[As].[Bi].[Sb]
InChIInChI=1S/As.Bi.H2O.H3P.H2S.Sb/h;;1H2;1H3;1H2;
InChIKeyRJKIQMTWJBTTHC-UHFFFAOYSA-N
MW491.76 g/mol
LogP-1.80
Rot. Bonds
About CID 172741873
CID 172741873 (PubChem CID 172741873) has the molecular formula H7AsBiOPSSb and a molecular weight of 491.76 g/mol.
Molecular Properties
| Compound Name | CID 172741873 |
|---|---|
| PubChem CID | 172741873 |
| Molecular Formula | H7AsBiOPSSb |
| Molecular Weight | 491.76 g/mol |
| Exact Mass | 490.80 |
| IUPAC Name | — |
| SMILES | O.P.S.[As].[Bi].[Sb] |
| InChI | InChI=1S/As.Bi.H2O.H3P.H2S.Sb/h;;1H2;1H3;1H2; |
| InChIKey | RJKIQMTWJBTTHC-UHFFFAOYSA-N |
| XLogP | -1.80 |
| TPSA | 31.50 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | |
| Heavy Atoms | 6 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 491.76 |
| LogP ≤ 5 | -1.80 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'} |
|---|
Frequently Asked Questions
What is the IUPAC name of CID 172741873?
The IUPAC name of CID 172741873 (CID 172741873) is not available.
What is the SMILES notation for CID 172741873?
The canonical SMILES for CID 172741873 is O.P.S.[As].[Bi].[Sb].
What is the InChIKey of CID 172741873?
The InChIKey is RJKIQMTWJBTTHC-UHFFFAOYSA-N. The full InChI is InChI=1S/As.Bi.H2O.H3P.H2S.Sb/h;;1H2;1H3;1H2;.
What are the key properties of CID 172741873?
CID 172741873 has a molecular weight of 491.76 g/mol, XLogP of -1.80, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 172741873 is sourced from PubChem (CID 172741873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).
Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.
Sources
- PubChem CID 172741873 — identifiers, structure, computed properties (public domain)
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