4-Amino-5-methyl-3-(morpholin-4-yl)-3H-1,2,3-oxadiazol-1-ium chloride
Basic information
- CAS
29833-28-1- Standard SMILES
Cc1on[n+](N2CCOCC2)c1N.[Cl-]- InChIKey
QZECQBXEMUZMBT-UHFFFAOYSA-M- Molecular formula
- C7H13ClN4O2
- Average molar mass
- 220.66 g/mol
- Monoisotopic mass
- 220.0727034
Names & identifiers
- Preferred name
- 4-Amino-5-methyl-3-(morpholin-4-yl)-3H-1,2,3-oxadiazol-1-ium chloride
- IUPAC
- 5-methyl-3-morpholin-4-yloxadiazol-3-ium-4-amine chloride
- English name
- Sydnone imine, 4-methyl-3-morpholino-, monohydrochloride
- Molecular weight
- 0
Names & synonyms
29833-28-1DTXSID309522604-Amino-5-methyl-3-(morpholin-4-yl)-3H-1,2,3-oxadiazol-1-ium chlorideRefChem:1070284DTXCID9013803594-Methyl-3-morpholinosydnone imine hydrochlorideSydnone imine, 4-methyl-3-morpholino-, monohydrochloride
Database identifiers
- CAS
29833-28-1- PubChem CID
- 207387
- DTXSID
DTXSID30952260
Properties
Computed structural properties
- Topological polar surface area
- 68.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 174
Physicochemical properties
- EWG's Food Scores
- 1 · 1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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