(hydroxysulfonimidoyl)oxymethane

CH5NO3S — CID 58683502

IUPAC(hydroxysulfonimidoyl)oxymethane
SMILES[H]N=S(=O)(O)OC
InChIInChI=1S/CH5NO3S/c1-5-6(2,3)4/h1H3,(H2,2,3,4)
InChIKeyFIYXUOWXHWJDAM-UHFFFAOYSA-N
MW111.12 g/mol
LogP0.07
Rot. Bonds1

About (hydroxysulfonimidoyl)oxymethane

(hydroxysulfonimidoyl)oxymethane (PubChem CID 58683502) has the molecular formula CH5NO3S and a molecular weight of 111.12 g/mol. Its IUPAC name is (hydroxysulfonimidoyl)oxymethane.

Molecular Properties

Compound Name(hydroxysulfonimidoyl)oxymethane
PubChem CID58683502
Molecular FormulaCH5NO3S
Molecular Weight111.12 g/mol
Exact Mass111.00
IUPAC Name(hydroxysulfonimidoyl)oxymethane
SMILES[H]N=S(=O)(O)OC
InChIInChI=1S/CH5NO3S/c1-5-6(2,3)4/h1H3,(H2,2,3,4)
InChIKeyFIYXUOWXHWJDAM-UHFFFAOYSA-N
XLogP0.07
TPSA70.38 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.12
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (hydroxysulfonimidoyl)oxymethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl hydrogen sulfate;hydrobromide
CID 87338714
copper;methyl hydrogen sulfate
CID 175275891
(aminosulfonimidoyl)oxymethane
CID 87923018
azane;ethene;methyl hydrogen sulfate
CID 175445348
methyl hydrogen sulfate;oxalic acid
CID 88784416
methyl hydrogen sulfate;oxalonitrile
CID 161128067
bis(N,N-dimethylmethanamine);dimethyl sulfate;sulfuric acid
CID 174527843
CID 173431110
CID 173431110
hydroxy-methoxy-dimethyl-λ4-sulfane
CID 21017922
methyl hydrogen sulfate;phenol
CID 174688864
methanesulfonic acid;methyl acetate
CID 172690689
dimethyl sulfate;propan-2-one
CID 23134895

Frequently Asked Questions

What is the IUPAC name of (hydroxysulfonimidoyl)oxymethane?
The IUPAC name of (hydroxysulfonimidoyl)oxymethane (CID 58683502) is (hydroxysulfonimidoyl)oxymethane.
What is the SMILES notation for (hydroxysulfonimidoyl)oxymethane?
The canonical SMILES for (hydroxysulfonimidoyl)oxymethane is [H]N=S(=O)(O)OC.
What is the InChIKey of (hydroxysulfonimidoyl)oxymethane?
The InChIKey is FIYXUOWXHWJDAM-UHFFFAOYSA-N. The full InChI is InChI=1S/CH5NO3S/c1-5-6(2,3)4/h1H3,(H2,2,3,4).
What are the key properties of (hydroxysulfonimidoyl)oxymethane?
(hydroxysulfonimidoyl)oxymethane has a molecular weight of 111.12 g/mol, XLogP of 0.07, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (hydroxysulfonimidoyl)oxymethane is sourced from PubChem (CID 58683502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).