arsane;sulfuric acid

H9AsO12S3 — CID 173039505

IUPACarsane;sulfuric acid
SMILESO=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.[AsH3]
InChIInChI=1S/AsH3.3H2O4S/c;3*1-5(2,3)4/h1H3;3*(H2,1,2,3,4)
InChIKeyMNFZQJDIFSMSJO-UHFFFAOYSA-N
MW372.18 g/mol
LogP-3.14
Rot. Bonds

About arsane;sulfuric acid

arsane;sulfuric acid (PubChem CID 173039505) has the molecular formula H9AsO12S3 and a molecular weight of 372.18 g/mol. Its IUPAC name is arsane;sulfuric acid.

Molecular Properties

Compound Namearsane;sulfuric acid
PubChem CID173039505
Molecular FormulaH9AsO12S3
Molecular Weight372.18 g/mol
Exact Mass371.85
IUPAC Namearsane;sulfuric acid
SMILESO=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.[AsH3]
InChIInChI=1S/AsH3.3H2O4S/c;3*1-5(2,3)4/h1H3;3*(H2,1,2,3,4)
InChIKeyMNFZQJDIFSMSJO-UHFFFAOYSA-N
XLogP-3.14
TPSA223.80 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.18
LogP ≤ 5-3.14
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of arsane;sulfuric acid?
The IUPAC name of arsane;sulfuric acid (CID 173039505) is arsane;sulfuric acid.
What is the SMILES notation for arsane;sulfuric acid?
The canonical SMILES for arsane;sulfuric acid is O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.[AsH3].
What is the InChIKey of arsane;sulfuric acid?
The InChIKey is MNFZQJDIFSMSJO-UHFFFAOYSA-N. The full InChI is InChI=1S/AsH3.3H2O4S/c;3*1-5(2,3)4/h1H3;3*(H2,1,2,3,4).
What are the key properties of arsane;sulfuric acid?
arsane;sulfuric acid has a molecular weight of 372.18 g/mol, XLogP of -3.14, 0 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for arsane;sulfuric acid is sourced from PubChem (CID 173039505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).