sulfinamoyl hydrogen sulfite

H3NO4S2 — CID 174417380

IUPACsulfinamoyl hydrogen sulfite
SMILESNS(=O)OS(=O)O
InChIInChI=1S/H3NO4S2/c1-6(2)5-7(3)4/h1H2,(H,3,4)
InChIKeyZLZBVZBKTTTXMG-UHFFFAOYSA-N
MW145.16 g/mol
LogP-1.32
Rot. Bonds2

About sulfinamoyl hydrogen sulfite

sulfinamoyl hydrogen sulfite (PubChem CID 174417380) has the molecular formula H3NO4S2 and a molecular weight of 145.16 g/mol. Its IUPAC name is sulfinamoyl hydrogen sulfite.

Molecular Properties

Compound Namesulfinamoyl hydrogen sulfite
PubChem CID174417380
Molecular FormulaH3NO4S2
Molecular Weight145.16 g/mol
Exact Mass144.95
IUPAC Namesulfinamoyl hydrogen sulfite
SMILESNS(=O)OS(=O)O
InChIInChI=1S/H3NO4S2/c1-6(2)5-7(3)4/h1H2,(H,3,4)
InChIKeyZLZBVZBKTTTXMG-UHFFFAOYSA-N
XLogP-1.32
TPSA89.62 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-1.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

silver;sulfino hydrogen sulfite
CID 174707247
dodecasodium;bis(sulfinooxysulfinyloxysulfinyloxysulfinyloxysulfinyl) sulfite;hydride
CID 174535476
CID 20686844
CID 20686844
sulfinooxyperoxy hydrogen sulfite
CID 22763520
acetaldehyde;amino hydrogen sulfite
CID 87411142
disulfino (Z)-but-2-enedioate
CID 174905476
2-aminoethenyl hydrogen sulfite
CID 174363043
phosphane;sulfurous acid
CID 173229936
CID 162004424
CID 162004424
arsane;sulfurous acid
CID 173343664
iron;sulfurous acid
CID 175438968
hydron;sulfurous acid
CID 173020149

Frequently Asked Questions

What is the IUPAC name of sulfinamoyl hydrogen sulfite?
The IUPAC name of sulfinamoyl hydrogen sulfite (CID 174417380) is sulfinamoyl hydrogen sulfite.
What is the SMILES notation for sulfinamoyl hydrogen sulfite?
The canonical SMILES for sulfinamoyl hydrogen sulfite is NS(=O)OS(=O)O.
What is the InChIKey of sulfinamoyl hydrogen sulfite?
The InChIKey is ZLZBVZBKTTTXMG-UHFFFAOYSA-N. The full InChI is InChI=1S/H3NO4S2/c1-6(2)5-7(3)4/h1H2,(H,3,4).
What are the key properties of sulfinamoyl hydrogen sulfite?
sulfinamoyl hydrogen sulfite has a molecular weight of 145.16 g/mol, XLogP of -1.32, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sulfinamoyl hydrogen sulfite is sourced from PubChem (CID 174417380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).