CID 162461372

C2H2O4S2Y2-4 — CID 162461372

IUPAC—
SMILESO=[C-]O.O=[C-]O.[S-][S-].[Y].[Y]
InChIInChI=1S/2CHO2.S2.2Y/c2*2-1-3;1-2;;/h2*(H,2,3);;;/q2*-1;-2;;
InChIKeyKFGSKMKFLFYTJR-UHFFFAOYSA-N
MW331.98 g/mol
LogP-0.79
Rot. Bonds

About CID 162461372

CID 162461372 (PubChem CID 162461372) has the molecular formula C2H2O4S2Y2-4 and a molecular weight of 331.98 g/mol.

Molecular Properties

Compound NameCID 162461372
PubChem CID162461372
Molecular FormulaC2H2O4S2Y2-4
Molecular Weight331.98 g/mol
Exact Mass331.75
IUPAC Name—
SMILESO=[C-]O.O=[C-]O.[S-][S-].[Y].[Y]
InChIInChI=1S/2CHO2.S2.2Y/c2*2-1-3;1-2;;/h2*(H,2,3);;;/q2*-1;-2;;
InChIKeyKFGSKMKFLFYTJR-UHFFFAOYSA-N
XLogP-0.79
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.98
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'thiol_1', 'substructure': 'N/A'}

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Related Compounds

hydroxymethanone
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CID 172995275
hydroxymethanone;tungsten
CID 141151866
sodium;hydroxymethanone;phosphane
CID 159362533
hydroxymethanone;oxovanadium(2+)
CID 87184679
bismuthane;hydroxymethanone;zinc
CID 174420136
copper(1+);hydroxymethanone;methane
CID 174882093
silver;azane;hydroxymethanone
CID 166682246
disodium;hydroxymethanone;bis(iron(3+))
CID 173448481

Frequently Asked Questions

What is the IUPAC name of CID 162461372?
The IUPAC name of CID 162461372 (CID 162461372) is not available.
What is the SMILES notation for CID 162461372?
The canonical SMILES for CID 162461372 is O=[C-]O.O=[C-]O.[S-][S-].[Y].[Y].
What is the InChIKey of CID 162461372?
The InChIKey is KFGSKMKFLFYTJR-UHFFFAOYSA-N. The full InChI is InChI=1S/2CHO2.S2.2Y/c2*2-1-3;1-2;;/h2*(H,2,3);;;/q2*-1;-2;;.
What are the key properties of CID 162461372?
CID 162461372 has a molecular weight of 331.98 g/mol, XLogP of -0.79, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 162461372 is sourced from PubChem (CID 162461372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).