azane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate

H13ClN3O8S2+ — CID 158915649

IUPACazane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate
SMILESN.N.N.O.O=S(=O)=O.O=S(=O)=O.OCl.[H+]
InChIInChI=1S/ClHO.3H3N.2O3S.H2O/c1-2;;;;2*1-4(2)3;/h2H;3*1H3;;;1H2/p+1
InChIKeyKGQXSCNYEDHGJQ-UHFFFAOYSA-O
MW282.70 g/mol
LogP-2.10
Rot. Bonds

About azane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate

azane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate (PubChem CID 158915649) has the molecular formula H13ClN3O8S2+ and a molecular weight of 282.70 g/mol. Its IUPAC name is azane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate.

Molecular Properties

Compound Nameazane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate
PubChem CID158915649
Molecular FormulaH13ClN3O8S2+
Molecular Weight282.70 g/mol
Exact Mass281.98
IUPAC Nameazane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate
SMILESN.N.N.O.O=S(=O)=O.O=S(=O)=O.OCl.[H+]
InChIInChI=1S/ClHO.3H3N.2O3S.H2O/c1-2;;;;2*1-4(2)3;/h2H;3*1H3;;;1H2/p+1
InChIKeyKGQXSCNYEDHGJQ-UHFFFAOYSA-O
XLogP-2.10
TPSA259.15 Ų
H-Bond Donors4
H-Bond Acceptors10
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.70
LogP ≤ 5-2.10
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1010

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Frequently Asked Questions

What is the IUPAC name of azane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate?
The IUPAC name of azane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate (CID 158915649) is azane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate.
What is the SMILES notation for azane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate?
The canonical SMILES for azane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate is N.N.N.O.O=S(=O)=O.O=S(=O)=O.OCl.[H+].
What is the InChIKey of azane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate?
The InChIKey is KGQXSCNYEDHGJQ-UHFFFAOYSA-O. The full InChI is InChI=1S/ClHO.3H3N.2O3S.H2O/c1-2;;;;2*1-4(2)3;/h2H;3*1H3;;;1H2/p+1.
What are the key properties of azane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate?
azane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate has a molecular weight of 282.70 g/mol, XLogP of -2.10, 0 rotatable bonds, 4 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for azane;hydron;hypochlorous acid;bis(sulfur trioxide);hydrate is sourced from PubChem (CID 158915649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).