methanesulfonamide;sulfuric acid

CH7NO6S2 — CID 21418740

IUPACmethanesulfonamide;sulfuric acid
SMILESCS(N)(=O)=O.O=S(=O)(O)O
InChIInChI=1S/CH5NO2S.H2O4S/c2*1-5(2,3)4/h1H3,(H2,2,3,4);(H2,1,2,3,4)
InChIKeyLPHPMJIQEQHUCB-UHFFFAOYSA-N
MW193.20 g/mol
LogP-1.75
Rot. Bonds

About methanesulfonamide;sulfuric acid

methanesulfonamide;sulfuric acid (PubChem CID 21418740) has the molecular formula CH7NO6S2 and a molecular weight of 193.20 g/mol. Its IUPAC name is methanesulfonamide;sulfuric acid.

Molecular Properties

Compound Namemethanesulfonamide;sulfuric acid
PubChem CID21418740
Molecular FormulaCH7NO6S2
Molecular Weight193.20 g/mol
Exact Mass192.97
IUPAC Namemethanesulfonamide;sulfuric acid
SMILESCS(N)(=O)=O.O=S(=O)(O)O
InChIInChI=1S/CH5NO2S.H2O4S/c2*1-5(2,3)4/h1H3,(H2,2,3,4);(H2,1,2,3,4)
InChIKeyLPHPMJIQEQHUCB-UHFFFAOYSA-N
XLogP-1.75
TPSA134.76 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 5-1.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

Methanesulfonamide, N-(methylsulfonyl)-
CID 79296
Methanesulfonyl sulfonamide
CID 23135099
Fluorosulfonyl(methylsulfonyl)sulfamic acid
CID 166859217
N-methylsulfonylsulfamoyl chloride
CID 19755022
Methylsulfonylsulfamic acid
CID 20281755
Sulfinatosulfamoylmethane
CID 20677081
Hydroxylamine;methanesulfonic acid
CID 21516870
Methanesulfonic acid;sulfamic acid
CID 21617510
N-sulfamoylmethanesulfonamide
CID 53879119
Sulfamoylmethanesulfonic acid
CID 54528747
N-(hydroxy-methylidene-oxo-lambda6-sulfanyl)methanesulfonamide
CID 56634009
[Hydroxy-oxo-(sulfamoylamino)-lambda6-sulfanylidene]methane
CID 57211960

Frequently Asked Questions

What is the IUPAC name of methanesulfonamide;sulfuric acid?
The IUPAC name of methanesulfonamide;sulfuric acid (CID 21418740) is methanesulfonamide;sulfuric acid.
What is the SMILES notation for methanesulfonamide;sulfuric acid?
The canonical SMILES for methanesulfonamide;sulfuric acid is CS(N)(=O)=O.O=S(=O)(O)O.
What is the InChIKey of methanesulfonamide;sulfuric acid?
The InChIKey is LPHPMJIQEQHUCB-UHFFFAOYSA-N. The full InChI is InChI=1S/CH5NO2S.H2O4S/c2*1-5(2,3)4/h1H3,(H2,2,3,4);(H2,1,2,3,4).
What are the key properties of methanesulfonamide;sulfuric acid?
methanesulfonamide;sulfuric acid has a molecular weight of 193.20 g/mol, XLogP of -1.75, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methanesulfonamide;sulfuric acid is sourced from PubChem (CID 21418740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).