Basic information
- CAS
19951-50-9- Standard SMILES
CCCCCCCCCc1c(N)on[n+]1C.[Cl-]- InChIKey
CRYMQNCOGJZOPC-UHFFFAOYSA-M- Molecular formula
- C12H24ClN3O
- Average molar mass
- 261.79 g/mol
- Monoisotopic mass
- 261.1607901
Names & identifiers
- Preferred name
- 5-Amino-3-methyl-4-nonyl-3H-1,2,3-oxadiazol-1-ium chloride
- IUPAC
- 3-methyl-4-nonyloxadiazol-3-ium-5-amine chloride
- English name
- 3-methyl-4-nonyl-1-oxa-2-aza-3-azoniacyclopenta-2,4-dien-5-amine chlor ide
- Molecular formula
- C12H24N3O.Cl
- Molecular weight
- 261.79
Names & synonyms
19951-50-9DTXSID409418625-Amino-3-methyl-4-nonyl-3H-1,2,3-oxadiazol-1-ium chlorideRefChem:1072629DTXCID1013702853-Methyl-4-n-nonylsydnonimine hydrochlorideSydnone imine, 3-methyl-4-nonyl-, monohydrochloride3-methyl-4-nonyloxadiazol-3-ium-5-amine;chloride3-methyl-4-nonyl-1-oxa-2-aza-3-azoniacyclopenta-2,4-dien-5-amine chlor ide
Database identifiers
- CAS
19951-50-9- PubChem CID
- 209489
- DTXSID
DTXSID40941862
Properties
Computed structural properties
- Topological polar surface area
- 55.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 178
Physicochemical properties
- Melting point
- 121 · 121-122 °C
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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