Basic information
- CAS
890324-23-9- Standard SMILES
CCNCc1nc(-c2cccc(C)c2)no1.Cl- InChIKey
ZCGPKKVXBPJECQ-UHFFFAOYSA-N- Molecular formula
- C12H16ClN3O
- Average molar mass
- 253.73 g/mol
- Monoisotopic mass
- 253.0981898
Names & identifiers
- Preferred name
- N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine Hydrochloride
- IUPAC
- N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine;hydrochloride
- English name
- N-([3-(3-Methylphenyl)-1,2,4-oxadiazol-5-yl]methyl)ethanamine hydrochloride
- Molecular formula
- C12H15N3O
- Molecular weight
- 217.27
Names & synonyms
890324-23-9N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine HydrochlorideN-{[3-(3-METHYLPHENYL)-1,2,4-OXADIAZOL-5-YL]METHYL}ETHANAMINE HYDROCHLORIDEMFCD07363425N-((3-(m-Tolyl)-1,2,4-oxadiazol-5-yl)methyl)ethanamine hydrochlorideN-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine;hydrochlorideETHYL({[3-(3-METHYLPHENYL)-1,2,4-OXADIAZOL-5-YL]METHYL})AMINE HYDROCHLORIDEN-([3-(3-Methylphenyl)-1,2,4-oxadiazol-5-yl]methyl)ethanamine hydrochlorideDTXSID503881831049717-66-9BS-36883ST50736240
Show more names
N-((3-(m-tolyl)-1,2,4-oxadiazol-5-yl)methyl)ethanamine1,2,4-Oxadiazole-5-methanamine, N-ethyl-3-(3-methylphenyl)-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamineN-{[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}ethanamine hydrochloride(SALTDATA: FREE)
N-((3-(m-Tolyl)-1,2,4-oxadiazol-5-yl)methyl)ethanaminehydrochlorideN-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methyl]ethanamine;hydrochlorideN-{[3-(3-Methylphenyl)-1,2,4-oxadiazol-5-yl]methyl}ethanamine--hydrogen chloride (1/1)
Properties
Computed structural properties
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 212
Physicochemical properties
- Boiling point
- 354.9 · 354.9±52.0 °C(Predicted)
- Density
- 1.095 · 1.095±0.06 g/cm3(Predicted)
- pka
- 6.77 · 6.77±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers2 total
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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