CID 159269242

H6N2O4S2 — CID 159269242

IUPAC—
SMILESNN.O=S(O)S(=O)O
InChIInChI=1S/H4N2.H2O4S2/c1-2;1-5(2)6(3)4/h1-2H2;(H,1,2)(H,3,4)
InChIKeyKXMKPJCMRJASGZ-UHFFFAOYSA-N
MW162.19 g/mol
LogP-1.84
Rot. Bonds1

About CID 159269242

CID 159269242 (PubChem CID 159269242) has the molecular formula H6N2O4S2 and a molecular weight of 162.19 g/mol.

Molecular Properties

Compound NameCID 159269242
PubChem CID159269242
Molecular FormulaH6N2O4S2
Molecular Weight162.19 g/mol
Exact Mass161.98
IUPAC Name—
SMILESNN.O=S(O)S(=O)O
InChIInChI=1S/H4N2.H2O4S2/c1-2;1-5(2)6(3)4/h1-2H2;(H,1,2)(H,3,4)
InChIKeyKXMKPJCMRJASGZ-UHFFFAOYSA-N
XLogP-1.84
TPSA126.64 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.19
LogP ≤ 5-1.84
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'sulfinic_acid', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 159269242?
The IUPAC name of CID 159269242 (CID 159269242) is not available.
What is the SMILES notation for CID 159269242?
The canonical SMILES for CID 159269242 is NN.O=S(O)S(=O)O.
What is the InChIKey of CID 159269242?
The InChIKey is KXMKPJCMRJASGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/H4N2.H2O4S2/c1-2;1-5(2)6(3)4/h1-2H2;(H,1,2)(H,3,4).
What are the key properties of CID 159269242?
CID 159269242 has a molecular weight of 162.19 g/mol, XLogP of -1.84, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 159269242 is sourced from PubChem (CID 159269242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).